#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3inj s VAL 8 N 0.00 2.34 0.49 0.00 1.01 -1.26 -5.11 120.40 117.87 3inj s VAL 8 Ca 0.00 -0.87 -0.24 0.00 0.00 0.00 0.00 61.98 60.87 3inj s VAL 8 Cb 0.00 -1.97 -0.07 0.00 0.00 0.00 0.00 36.38 34.34 3inj s VAL 8 CO 0.00 0.53 1.41 -2.84 0.00 0.00 0.00 175.10 174.19 3inj s PRO 9 N 0.97 3.44 0.08 2.72 0.02 -1.26 -4.88 135.00 136.08 3inj s PRO 9 Ca -0.03 2.36 -0.31 0.00 0.02 0.00 0.00 61.00 63.04 3inj s PRO 9 Cb -0.15 -2.48 -0.09 0.00 0.02 0.00 0.00 34.50 31.80 3inj s PRO 9 CO -0.04 -0.99 1.73 0.00 -0.33 0.00 0.00 177.00 177.36 3inj s ALA 10 N -1.24 3.70 0.39 -1.55 0.00 -1.26 -4.94 121.76 116.86 3inj s ALA 10 Ca 0.66 1.28 -0.26 0.00 0.00 0.00 0.00 51.96 53.64 3inj s ALA 10 Cb -0.43 -3.73 -0.09 0.00 0.00 0.00 0.00 23.12 18.88 3inj s ALA 10 CO 0.53 -1.18 1.27 -1.25 0.00 0.00 0.00 175.76 175.13 3inj s PRO 11 N 2.82 4.07 -0.52 0.00 0.04 -1.26 -4.98 135.00 135.17 3inj s PRO 11 Ca 0.77 2.08 -0.28 0.00 0.04 0.00 0.00 61.00 63.61 3inj s PRO 11 Cb -0.42 -2.80 0.02 0.00 0.04 0.00 0.00 34.50 31.34 3inj s PRO 11 CO 0.34 -0.38 1.33 1.21 0.04 0.00 0.00 177.00 179.54 3inj s ASN 12 N -0.79 6.31 0.00 6.66 2.47 -1.26 -4.90 114.94 123.43 3inj s ASN 12 Ca 0.55 0.39 0.25 0.00 0.42 0.00 0.00 52.86 54.47 3inj s ASN 12 Cb -0.37 -2.55 1.19 0.00 -1.45 0.00 0.00 41.25 38.08 3inj s ASN 12 CO 0.47 -1.54 1.83 0.00 -3.72 0.00 0.00 177.10 174.14 3inj n GLN 13 N 8.38 0.21 -3.15 0.43 6.02 -1.26 -3.50 117.38 124.51 3inj n GLN 13 Ca 0.12 0.06 -0.23 0.00 -0.01 0.00 0.00 57.00 56.94 3inj n GLN 13 Cb 0.49 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.20 3inj n GLN 13 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3inj n GLN 14 N -1.37 1.83 -1.72 -1.09 6.02 -1.26 -5.02 117.38 114.76 3inj n GLN 14 Ca 0.10 -3.98 -0.43 0.00 -0.01 0.00 0.00 57.00 52.68 3inj n GLN 14 Cb 0.24 -1.85 -0.03 0.00 1.02 0.00 0.00 30.24 29.62 3inj n GLN 14 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3inj n PRO 15 N 0.42 2.65 -2.34 -1.09 -0.02 -1.23 -4.95 135.00 128.45 3inj n PRO 15 Ca 0.27 0.95 -0.37 0.00 -2.02 0.00 0.00 63.50 62.33 3inj n PRO 15 Cb 0.52 -2.76 -0.02 0.00 -0.02 0.00 0.00 33.50 31.22 3inj n PRO 15 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3inj s GLU 16 N 0.56 3.84 -0.20 -0.52 2.12 -1.26 -5.02 118.70 118.23 3inj s GLU 16 Ca 0.72 1.69 -0.07 0.00 0.36 0.00 0.00 54.97 57.67 3inj s GLU 16 Cb -0.53 -2.41 -0.04 0.00 0.26 0.00 0.00 34.13 31.41 3inj s GLU 16 CO 0.39 -0.46 0.05 0.08 -0.54 0.00 0.00 175.26 174.77 3inj s VAL 17 N -1.60 4.49 -0.07 3.70 1.01 -1.26 -4.97 120.40 121.70 3inj s VAL 17 Ca 0.63 -0.13 0.09 0.00 0.00 0.00 0.00 61.98 62.56 3inj s VAL 17 Cb -0.26 -3.04 -0.13 0.00 0.00 0.00 0.00 36.38 32.95 3inj s VAL 17 CO 0.32 0.43 0.09 0.49 0.00 0.00 0.00 175.10 176.43 3inj n PHE 18 N 3.92 0.00 -4.01 5.22 3.01 -1.26 -4.97 117.46 119.36 3inj n PHE 18 Ca -0.17 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 57.99 3inj n PHE 18 Cb 0.52 -0.40 -0.16 0.00 -0.01 0.00 0.00 39.48 39.43 3inj n PHE 18 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3inj n ASN 20 N 4.67 0.33 -2.59 0.00 2.04 -1.26 -4.68 115.26 113.78 3inj n ASN 20 Ca -0.15 -1.91 -0.09 0.00 -0.44 0.00 0.00 54.58 51.99 3inj n ASN 20 Cb 0.47 -0.17 -0.02 0.00 -2.53 0.00 0.00 39.78 37.53 3inj n ASN 20 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3inj n GLN 21 N 0.22 1.38 -3.16 -3.83 6.02 -1.26 -1.09 117.38 115.66 3inj n GLN 21 Ca -0.01 -1.06 -0.39 0.00 -0.01 0.00 0.00 57.00 55.54 3inj n GLN 21 Cb 0.88 0.37 -0.06 0.00 1.02 0.00 0.00 30.24 32.46 3inj n GLN 21 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3inj s ILE 22 N -1.68 4.78 -0.35 5.09 1.01 0.12 -4.80 121.20 125.37 3inj s ILE 22 Ca 0.02 1.35 -0.11 0.00 0.00 0.00 0.00 60.65 61.91 3inj s ILE 22 Cb 0.00 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.51 3inj s ILE 22 CO 0.01 0.46 0.20 0.12 0.00 0.00 0.00 174.94 175.73 3inj s PHE 23 N -0.51 3.22 -0.01 3.97 5.36 -0.71 0.50 117.98 129.80 3inj s PHE 23 Ca 0.32 -0.72 -0.00 0.00 -0.96 0.00 0.00 56.93 55.57 3inj s PHE 23 Cb -0.19 -2.43 0.01 0.00 -0.34 0.00 0.00 43.02 40.07 3inj s PHE 23 CO 0.20 -0.55 0.01 0.42 -1.46 0.00 0.00 175.22 173.84 3inj s ILE 24 N 1.60 -0.01 -1.61 3.12 1.01 -0.24 -1.50 121.20 123.58 3inj s ILE 24 Ca 0.04 0.05 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 3inj s ILE 24 Cb -0.18 -0.03 0.11 0.00 0.01 0.00 0.00 42.46 42.37 3inj s ILE 24 CO 0.07 0.02 0.82 0.59 0.00 0.00 0.00 174.94 176.44 3inj n ASN 25 N 3.33 -3.47 -2.39 3.58 3.02 -1.26 -0.65 115.26 117.43 3inj n ASN 25 Ca -0.16 -0.93 -0.21 0.00 -0.03 0.00 0.00 54.58 53.26 3inj n ASN 25 Cb 0.58 -3.21 -0.01 0.00 -0.61 0.00 0.00 39.78 36.52 3inj n ASN 25 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3inj n ASN 26 N -2.76 -5.94 -4.06 6.41 5.03 -1.26 -4.65 115.26 108.03 3inj n ASN 26 Ca 0.01 -0.01 -0.08 0.00 0.87 0.00 0.00 54.58 55.38 3inj n ASN 26 Cb 0.53 -4.95 -0.10 0.00 -1.02 0.00 0.00 39.78 34.25 3inj n ASN 26 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 3inj s GLU 27 N -5.03 0.68 -0.21 3.52 2.02 0.18 -5.03 118.70 114.84 3inj s GLU 27 Ca 0.00 -1.20 -0.07 0.00 0.02 0.00 0.00 54.97 53.71 3inj s GLU 27 Cb 0.00 0.23 -0.04 0.00 0.10 0.00 0.00 34.13 34.43 3inj s GLU 27 CO 0.00 -0.15 0.07 -1.58 0.02 0.00 0.00 175.26 173.62 3inj s TRP 28 N -3.92 3.18 0.00 1.61 0.52 -1.26 -1.07 118.94 118.00 3inj s TRP 28 Ca 0.08 -0.09 0.08 0.00 0.02 0.00 0.00 56.10 56.19 3inj s TRP 28 Cb 0.07 -2.15 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 3inj s TRP 28 CO -0.09 -0.04 -0.24 -1.01 0.02 0.00 0.00 176.95 175.59 3inj s HIS 29 N 0.88 2.11 0.88 -1.98 3.76 0.18 -4.89 115.29 116.23 3inj s HIS 29 Ca 0.04 -0.40 -0.11 0.00 -0.15 0.00 0.00 55.06 54.44 3inj s HIS 29 Cb -0.14 -1.32 0.12 0.00 1.11 0.00 0.00 32.58 32.35 3inj s HIS 29 CO 0.03 0.02 1.09 -0.51 -0.85 0.00 0.00 174.74 174.52 3inj s ASP 30 N -0.79 3.52 0.56 1.40 -0.00 -1.26 0.11 116.67 120.20 3inj s ASP 30 Ca 0.09 1.68 -0.20 0.00 -0.00 0.00 0.00 52.55 54.12 3inj s ASP 30 Cb -0.09 -2.33 -0.04 0.00 -0.00 0.00 0.00 42.92 40.45 3inj s ASP 30 CO 0.00 -2.64 1.24 0.00 -0.00 0.00 0.00 175.17 173.77 3inj s ALA 31 N -2.86 2.66 0.42 5.23 0.00 -1.26 -4.81 121.76 121.15 3inj s ALA 31 Ca 0.64 1.07 0.15 0.00 0.00 0.00 0.00 51.96 53.82 3inj s ALA 31 Cb -0.19 -3.47 1.03 0.00 0.00 0.00 0.00 23.12 20.49 3inj s ALA 31 CO 0.57 -1.14 1.90 0.28 0.00 0.00 0.00 175.76 177.38 3inj h VAL 32 N 1.15 0.78 -0.00 0.00 2.07 -1.94 0.59 116.25 118.90 3inj h VAL 32 Ca -0.50 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3inj h VAL 32 Cb 1.29 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3inj h VAL 32 CO 0.56 0.08 -0.01 -1.54 0.02 0.00 0.00 177.57 176.68 3inj n SER 33 N -4.49 0.33 0.00 0.57 3.41 -1.26 -4.88 113.62 107.29 3inj n SER 33 Ca 0.16 -0.95 0.00 0.00 -0.26 0.00 0.00 58.87 57.81 3inj n SER 33 Cb 0.55 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3inj n SER 33 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3inj n ARG 34 N -0.81 -1.87 -2.78 4.33 5.12 0.20 -4.96 116.66 115.89 3inj n ARG 34 Ca 0.21 0.47 -0.33 0.00 -1.93 0.00 0.00 57.85 56.26 3inj n ARG 34 Cb 0.19 -4.90 -0.07 0.00 -1.16 0.00 0.00 32.46 26.52 3inj n ARG 34 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3inj s LYS 35 N -1.89 4.20 0.07 5.56 1.02 -1.26 -4.84 119.74 122.60 3inj s LYS 35 Ca 0.00 1.16 0.02 0.00 0.02 0.00 0.00 55.97 57.17 3inj s LYS 35 Cb 0.00 -2.21 -0.03 0.00 -0.52 0.00 0.00 37.83 35.06 3inj s LYS 35 CO 0.00 -0.06 -0.07 0.95 -0.92 0.00 0.00 175.35 175.25 3inj s THR 36 N -2.12 0.63 0.04 2.17 -4.23 -1.26 -1.47 115.64 109.40 3inj s THR 36 Ca 0.62 -1.58 0.06 0.00 -1.18 0.00 0.00 61.69 59.61 3inj s THR 36 Cb -0.11 -1.24 -0.02 0.00 1.34 0.00 0.00 72.50 72.47 3inj s THR 36 CO 0.15 -0.67 -0.18 0.72 -0.54 0.00 0.00 174.62 174.10 3inj s PHE 37 N -2.70 1.55 0.26 3.99 -0.12 0.69 -4.80 117.98 116.85 3inj s PHE 37 Ca 0.03 -0.36 -0.27 0.00 -0.05 0.00 0.00 56.93 56.28 3inj s PHE 37 Cb -0.01 -0.92 -0.09 0.00 -0.63 0.00 0.00 43.02 41.37 3inj s PHE 37 CO -0.03 0.06 0.90 -1.25 -0.05 0.00 0.00 175.22 174.86 3inj s PRO 38 N -1.13 4.68 -0.08 1.99 0.04 -1.26 -0.61 135.00 138.63 3inj s PRO 38 Ca 0.05 1.34 -0.00 0.00 0.04 0.00 0.00 61.00 62.43 3inj s PRO 38 Cb -0.08 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.34 3inj s PRO 38 CO 0.01 0.44 -0.05 -0.08 0.04 0.00 0.00 177.00 177.36 3inj s THR 39 N -1.35 3.85 0.09 1.26 -1.32 -0.85 -4.95 115.64 112.37 3inj s THR 39 Ca 0.43 -0.42 0.07 0.00 -1.21 0.00 0.00 61.69 60.56 3inj s THR 39 Cb -0.22 -2.59 -0.04 0.00 -1.51 0.00 0.00 72.50 68.14 3inj s THR 39 CO 0.27 0.60 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.49 3inj s VAL 40 N -0.77 3.37 -0.43 5.08 1.01 -1.26 -0.33 120.40 127.07 3inj s VAL 40 Ca 0.12 -1.20 -0.26 0.00 0.00 0.00 0.00 61.98 60.63 3inj s VAL 40 Cb -0.11 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.74 3inj s VAL 40 CO 0.02 0.16 0.97 0.21 0.00 0.00 0.00 175.10 176.45 3inj s ASN 41 N -2.06 6.59 0.41 3.32 3.04 -0.06 -4.78 114.94 121.40 3inj s ASN 41 Ca 0.20 0.34 0.29 0.00 0.04 0.00 0.00 52.86 53.74 3inj s ASN 41 Cb -0.11 -2.47 1.40 0.00 -1.54 0.00 0.00 41.25 38.52 3inj s ASN 41 CO 0.12 -1.02 1.88 1.55 -3.04 0.00 0.00 177.10 176.59 3inj h PRO 42 N 8.90 0.00 -0.01 0.43 0.13 -1.80 0.24 132.00 139.88 3inj h PRO 42 Ca -0.23 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.72 3inj h PRO 42 Cb 1.07 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 3inj h PRO 42 CO 1.03 0.00 -0.79 0.77 -0.23 0.00 0.00 178.00 178.78 3inj h SER 43 N 0.00 0.12 0.00 1.44 0.02 -1.89 -2.38 113.55 110.87 3inj h SER 43 Ca 0.00 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 3inj h SER 43 Cb 0.21 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 3inj h SER 43 CO 0.00 0.86 -1.04 0.35 -1.14 0.00 0.00 176.83 175.86 3inj n THR 44 N -3.67 0.01 -0.81 -2.27 -2.24 -0.86 -3.37 114.28 101.07 3inj n THR 44 Ca -0.02 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3inj n THR 44 Cb 0.75 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 3inj n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3inj n GLY 45 N 2.62 0.80 3.88 3.38 0.00 0.78 -4.42 105.19 112.23 3inj n GLY 45 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3inj n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3inj s GLU 46 N -0.19 3.75 0.07 1.61 2.02 -1.24 -4.81 118.70 119.92 3inj s GLU 46 Ca 0.00 0.18 -0.31 0.00 0.02 0.00 0.00 54.97 54.87 3inj s GLU 46 Cb 0.00 -2.69 -0.07 0.00 0.10 0.00 0.00 34.13 31.47 3inj s GLU 46 CO 0.00 0.34 1.41 0.08 0.02 0.00 0.00 175.26 177.11 3inj s VAL 47 N -1.80 3.45 -0.12 2.63 1.01 -1.26 -0.88 120.40 123.43 3inj s VAL 47 Ca 0.46 0.98 -0.17 0.00 0.00 0.00 0.00 61.98 63.24 3inj s VAL 47 Cb -0.11 -3.63 -0.15 0.00 0.00 0.00 0.00 36.38 32.49 3inj s VAL 47 CO 0.22 0.04 0.50 0.40 0.00 0.00 0.00 175.10 176.26 3inj h ILE 48 N 4.53 1.04 -2.43 2.22 2.04 -1.01 -3.47 117.51 120.43 3inj h ILE 48 Ca -0.41 -1.73 0.17 0.00 1.00 0.00 0.00 64.86 63.89 3inj h ILE 48 Cb 1.20 1.94 -0.05 0.00 -0.74 0.00 0.00 36.82 39.17 3inj h ILE 48 CO 0.88 0.34 0.54 0.00 0.00 0.00 0.00 178.15 179.92 3inj s GLN 50 N -2.63 3.64 -0.00 0.00 -1.52 -1.26 -2.01 119.66 115.87 3inj s GLN 50 Ca 0.17 0.05 0.01 0.00 -1.95 0.00 0.00 55.36 53.65 3inj s GLN 50 Cb -0.02 -2.60 -0.00 0.00 -0.22 0.00 0.00 33.01 30.17 3inj s GLN 50 CO 0.04 0.15 -0.03 0.08 -0.25 0.00 0.00 175.29 175.28 3inj s VAL 51 N -2.17 0.25 -0.02 1.09 1.01 0.22 -4.86 120.40 115.92 3inj s VAL 51 Ca 0.45 -0.13 -0.38 0.00 0.00 0.00 0.00 61.98 61.92 3inj s VAL 51 Cb -0.11 -0.22 -0.16 0.00 0.00 0.00 0.00 36.38 35.89 3inj s VAL 51 CO 0.31 0.07 1.45 0.00 0.00 0.00 0.00 175.10 176.93 3inj n ALA 52 N 3.05 -0.82 -3.10 5.51 0.00 -0.25 -0.22 120.51 124.68 3inj n ALA 52 Ca -0.13 0.48 -0.45 0.00 0.00 0.00 0.00 53.44 53.34 3inj n ALA 52 Cb 0.59 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.89 3inj n ALA 52 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3inj s GLU 53 N 1.32 3.29 0.29 0.00 2.12 -0.54 -4.39 118.70 120.78 3inj s GLU 53 Ca 0.88 -1.63 -0.29 0.00 0.36 0.00 0.00 54.97 54.29 3inj s GLU 53 Cb -0.99 -4.45 -0.10 0.00 0.26 0.00 0.00 34.13 28.84 3inj s GLU 53 CO 0.52 -1.56 1.17 0.20 -0.54 0.00 0.00 175.26 175.05 3inj s GLY 54 N 3.35 3.03 0.05 -1.50 0.00 0.47 -4.77 107.32 107.95 3inj s GLY 54 Ca 0.18 1.01 0.00 0.00 0.00 0.00 0.00 44.72 45.92 3inj s GLY 54 CO -0.00 1.64 0.02 1.34 0.00 0.00 0.00 173.10 176.09 3inj n ASP 55 N 1.12 1.06 -0.33 1.64 -0.08 -1.26 -4.18 116.55 114.52 3inj n ASP 55 Ca -0.01 -1.25 0.07 0.00 -1.51 0.00 0.00 54.79 52.10 3inj n ASP 55 Cb 0.44 0.11 0.26 0.00 2.34 0.00 0.00 41.12 44.27 3inj n ASP 55 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 3inj h LYS 56 N 0.00 0.93 -0.16 -0.67 3.64 -1.93 -0.46 116.57 117.92 3inj h LYS 56 Ca -0.04 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 3inj h LYS 56 Cb 0.14 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3inj h LYS 56 CO 0.06 0.62 -0.11 0.93 -2.27 0.00 0.00 179.45 178.67 3inj h GLU 57 N 0.96 0.25 -0.02 1.90 5.08 -1.98 -0.38 114.58 120.40 3inj h GLU 57 Ca 0.45 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.63 3inj h GLU 57 Cb 0.43 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.65 3inj h GLU 57 CO -0.21 0.38 -0.50 -0.44 -1.00 0.00 0.00 179.01 177.23 3inj h ASP 58 N 0.24 0.47 -0.96 1.42 3.32 -1.52 -2.80 116.42 116.60 3inj h ASP 58 Ca 0.05 -0.74 0.05 0.00 0.02 0.00 0.00 57.03 56.40 3inj h ASP 58 Cb 0.36 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 3inj h ASP 58 CO 0.02 1.15 0.63 0.58 -1.72 0.00 0.00 179.24 179.89 3inj h VAL 59 N -0.17 1.14 -0.85 -1.35 2.07 -1.02 -1.14 116.25 114.94 3inj h VAL 59 Ca -0.06 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.08 3inj h VAL 59 Cb 1.21 -0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 3inj h VAL 59 CO 0.10 0.21 0.55 0.44 0.02 0.00 0.00 177.57 178.89 3inj h ASP 60 N 1.17 0.93 -0.73 0.57 5.19 -1.07 0.15 116.42 122.62 3inj h ASP 60 Ca 0.39 -0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.77 3inj h ASP 60 Cb 0.07 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 39.33 3inj h ASP 60 CO -0.13 0.65 0.39 0.11 -3.12 0.00 0.00 179.24 177.14 3inj h LYS 61 N 1.09 1.03 -0.41 3.56 1.57 -1.01 -2.15 116.57 120.25 3inj h LYS 61 Ca 0.33 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.92 3inj h LYS 61 Cb -0.03 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 3inj h LYS 61 CO -0.10 0.78 0.00 0.00 -0.57 0.00 0.00 179.45 179.56 3inj h ALA 62 N 1.20 0.55 -0.40 3.86 0.00 -0.32 -1.97 119.26 122.18 3inj h ALA 62 Ca 0.26 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3inj h ALA 62 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3inj h ALA 62 CO -0.04 0.33 -0.23 0.28 0.00 0.00 0.00 179.25 179.59 3inj h VAL 63 N 0.55 1.27 -0.34 0.00 2.07 -0.69 0.57 116.25 119.68 3inj h VAL 63 Ca 0.12 -1.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.27 3inj h VAL 63 Cb 0.47 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 3inj h VAL 63 CO 0.02 0.45 0.15 0.11 0.02 0.00 0.00 177.57 178.32 3inj h LYS 64 N 0.70 0.50 -0.28 1.57 1.57 -1.27 0.20 116.57 119.55 3inj h LYS 64 Ca 0.09 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3inj h LYS 64 Cb 0.75 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 3inj h LYS 64 CO 0.06 0.48 0.16 0.00 -0.57 0.00 0.00 179.45 179.58 3inj h ALA 65 N 0.99 0.34 -0.79 3.86 0.00 -1.17 -0.19 119.26 122.31 3inj h ALA 65 Ca 0.11 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3inj h ALA 65 Cb 0.16 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3inj h ALA 65 CO -0.01 -0.22 0.51 0.00 0.00 0.00 0.00 179.25 179.53 3inj h ALA 66 N 1.13 1.02 -0.50 0.00 0.00 -0.65 -1.26 119.26 119.00 3inj h ALA 66 Ca 0.11 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3inj h ALA 66 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3inj h ALA 66 CO -0.06 0.37 0.08 -0.09 0.00 0.00 0.00 179.25 179.55 3inj h ARG 67 N 1.03 0.83 -0.71 0.00 9.65 -0.25 -1.97 114.38 122.95 3inj h ARG 67 Ca 0.30 -0.22 -0.02 0.00 -1.10 0.00 0.00 59.98 58.94 3inj h ARG 67 Cb -0.06 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.39 3inj h ARG 67 CO -0.09 0.82 0.36 0.00 2.80 0.00 0.00 179.97 183.87 3inj h ALA 68 N 0.97 0.92 0.00 2.80 0.00 -0.67 -1.50 119.26 121.78 3inj h ALA 68 Ca 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3inj h ALA 68 Cb 0.40 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3inj h ALA 68 CO 0.01 0.46 -0.14 0.00 0.00 0.00 0.00 179.25 179.58 3inj h ALA 69 N 1.18 1.39 -0.01 0.00 0.00 -0.89 -2.22 119.26 118.71 3inj h ALA 69 Ca 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3inj h ALA 69 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3inj h ALA 69 CO -0.03 0.17 -0.10 0.34 0.00 0.00 0.00 179.25 179.63 3inj n PHE 70 N -3.81 0.00 -1.98 0.00 7.35 -0.59 -4.46 117.46 113.98 3inj n PHE 70 Ca -0.02 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.26 3inj n PHE 70 Cb 0.24 -0.06 -0.02 0.00 0.35 0.00 0.00 39.48 39.99 3inj n PHE 70 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 3inj s GLN 71 N -2.22 4.25 0.18 -4.13 -1.52 -0.84 -4.90 119.66 110.48 3inj s GLN 71 Ca 0.33 2.36 -0.33 0.00 -1.95 0.00 0.00 55.36 55.77 3inj s GLN 71 Cb 0.20 -3.07 -0.15 0.00 -0.22 0.00 0.00 33.01 29.77 3inj s GLN 71 CO 0.41 -0.41 1.27 -0.11 -0.25 0.00 0.00 175.29 176.20 3inj n LEU 72 N 1.70 2.01 0.00 2.90 7.94 -1.26 -1.52 117.00 128.78 3inj n LEU 72 Ca 0.05 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.08 3inj n LEU 72 Cb 0.40 -1.28 0.00 0.00 0.53 0.00 0.00 43.42 43.07 3inj n LEU 72 CO 0.61 -1.02 0.00 0.61 -1.11 0.00 0.00 177.39 176.48 3inj n GLY 73 N 2.18 0.98 3.80 -3.96 0.00 -1.26 -5.05 105.19 101.87 3inj n GLY 73 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 3inj n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 74 N -2.98 4.89 0.26 1.61 1.04 -0.57 -4.79 113.70 113.15 3inj s SER 74 Ca 0.00 1.63 -0.02 0.00 0.48 0.00 0.00 55.95 58.04 3inj s SER 74 Cb 0.00 -2.43 0.53 0.00 0.10 0.00 0.00 66.02 64.22 3inj s SER 74 CO 0.00 -1.76 1.72 -0.65 0.98 0.00 0.00 173.24 173.53 3inj h PRO 75 N -0.94 0.43 -0.30 4.02 0.11 -1.89 -0.59 132.00 132.84 3inj h PRO 75 Ca -0.44 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.51 3inj h PRO 75 Cb 1.23 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3inj h PRO 75 CO 0.55 0.29 -0.35 2.35 -0.21 0.00 0.00 178.00 180.63 3inj h TRP 76 N 0.45 0.79 -0.04 0.65 2.91 -1.92 -1.53 115.95 117.25 3inj h TRP 76 Ca 0.45 -0.22 -0.16 0.00 1.13 0.00 0.00 58.89 60.10 3inj h TRP 76 Cb 0.73 -0.18 -0.01 0.00 -0.51 0.00 0.00 29.16 29.19 3inj h TRP 76 CO -0.16 0.93 -0.67 0.00 -1.03 0.00 0.00 178.44 177.51 3inj h ARG 77 N 0.57 0.19 0.00 2.65 2.47 -1.68 -3.28 114.38 115.30 3inj h ARG 77 Ca 0.06 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.63 3inj h ARG 77 Cb 0.87 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.21 3inj h ARG 77 CO 0.07 0.79 -0.69 0.00 0.56 0.00 0.00 179.97 180.71 3inj h ARG 78 N 0.14 0.00 -6.72 0.04 3.08 -0.96 -3.47 114.38 106.48 3inj h ARG 78 Ca -0.01 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.48 3inj h ARG 78 Cb 1.20 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.34 3inj h ARG 78 CO 0.10 0.00 0.78 -0.12 -1.07 0.00 0.00 179.97 179.66 3inj n MET 79 N -2.61 2.46 -1.66 0.04 1.56 -0.59 -4.91 117.12 111.41 3inj n MET 79 Ca 0.02 0.87 -0.44 0.00 -0.27 0.00 0.00 57.70 57.88 3inj n MET 79 Cb 0.52 -2.61 -0.02 0.00 2.15 0.00 0.00 33.22 33.26 3inj n MET 79 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 3inj n ASP 80 N 2.15 2.37 -0.26 6.12 8.00 -1.26 -4.85 116.55 128.81 3inj n ASP 80 Ca 0.10 1.18 0.03 0.00 0.71 0.00 0.00 54.79 56.80 3inj n ASP 80 Cb 0.35 -1.41 0.16 0.00 -0.02 0.00 0.00 41.12 40.19 3inj n ASP 80 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3inj h ALA 81 N 2.96 1.06 -0.04 2.24 0.00 -1.91 0.28 119.26 123.86 3inj h ALA 81 Ca -0.44 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3inj h ALA 81 Cb 1.30 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 3inj h ALA 81 CO 0.66 -0.03 0.02 0.66 0.00 0.00 0.00 179.25 180.57 3inj h SER 82 N 0.64 0.04 -0.06 0.00 4.64 -1.90 -2.07 113.55 114.84 3inj h SER 82 Ca 0.38 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.52 3inj h SER 82 Cb 0.41 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 3inj h SER 82 CO -0.28 0.03 -0.59 -0.74 -0.87 0.00 0.00 176.83 174.37 3inj h HIS 83 N 0.05 0.85 -0.90 4.77 6.17 -1.31 -1.21 115.15 123.57 3inj h HIS 83 Ca 0.01 -0.32 0.13 0.00 0.71 0.00 0.00 60.37 60.91 3inj h HIS 83 Cb -0.00 -0.15 -0.07 0.00 2.52 0.00 0.00 27.41 29.70 3inj h HIS 83 CO -0.00 1.09 0.58 0.00 0.71 0.00 0.00 177.93 180.31 3inj h ARG 84 N 0.50 0.72 -0.21 5.26 3.08 -0.80 -0.57 114.38 122.37 3inj h ARG 84 Ca -0.00 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3inj h ARG 84 Cb 1.17 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 3inj h ARG 84 CO 0.12 0.48 0.09 0.78 -1.07 0.00 0.00 179.97 180.37 3inj h GLY 85 N 0.75 0.34 0.67 0.04 0.00 -1.01 -1.51 103.07 102.35 3inj h GLY 85 Ca 0.45 -0.18 0.09 0.00 0.00 0.00 0.00 47.33 47.69 3inj h GLY 85 CO -0.21 0.17 0.62 3.21 0.00 0.00 0.00 176.54 180.33 3inj h ARG 86 N 0.20 0.99 -0.30 4.80 2.47 -0.33 -0.74 114.38 121.46 3inj h ARG 86 Ca 0.07 -0.06 -0.15 0.00 -1.26 0.00 0.00 59.98 58.58 3inj h ARG 86 Cb 0.16 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.25 3inj h ARG 86 CO -0.01 0.66 -0.41 -0.07 0.56 0.00 0.00 179.97 180.70 3inj h LEU 87 N 1.02 0.78 -0.43 3.04 3.38 -0.82 0.67 115.31 122.96 3inj h LEU 87 Ca 0.44 -0.36 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 3inj h LEU 87 Cb 0.34 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3inj h LEU 87 CO -0.20 1.09 -0.43 -0.07 0.09 0.00 0.00 178.44 178.92 3inj h LEU 88 N 0.59 0.91 -0.81 1.67 3.38 -0.80 -1.35 115.31 118.90 3inj h LEU 88 Ca 0.05 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 3inj h LEU 88 Cb 0.95 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 3inj h LEU 88 CO 0.09 1.21 0.47 0.78 0.09 0.00 0.00 178.44 181.08 3inj h ASN 89 N 0.68 0.99 -0.65 -0.43 2.35 -0.98 -1.39 115.58 116.15 3inj h ASN 89 Ca 0.05 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3inj h ASN 89 Cb 1.01 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 39.10 3inj h ASN 89 CO 0.10 0.78 0.36 -0.09 -1.65 0.00 0.00 177.43 176.93 3inj h ARG 90 N 1.11 0.90 -0.83 0.81 9.65 -0.65 -0.83 114.38 124.54 3inj h ARG 90 Ca 0.29 -0.10 -0.00 0.00 -1.10 0.00 0.00 59.98 59.07 3inj h ARG 90 Cb -0.01 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.35 3inj h ARG 90 CO -0.05 0.67 0.51 1.25 2.80 0.00 0.00 179.97 185.15 3inj h LEU 91 N 0.88 0.98 -0.19 3.80 5.85 -0.99 -0.45 115.31 125.20 3inj h LEU 91 Ca 0.23 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3inj h LEU 91 Cb 0.03 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 3inj h LEU 91 CO -0.04 0.75 0.09 0.00 -0.34 0.00 0.00 178.44 178.90 3inj h ALA 92 N 1.42 0.24 -0.98 1.25 0.00 -0.75 -0.99 119.26 119.46 3inj h ALA 92 Ca 0.30 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3inj h ALA 92 Cb -0.06 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3inj h ALA 92 CO -0.06 -0.20 0.64 -0.44 0.00 0.00 0.00 179.25 179.20 3inj h ASP 93 N 0.17 1.09 -0.41 0.00 3.32 -0.68 0.12 116.42 120.03 3inj h ASP 93 Ca 0.06 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 3inj h ASP 93 Cb 0.12 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3inj h ASP 93 CO -0.01 0.76 -0.15 -0.07 -1.72 0.00 0.00 179.24 178.05 3inj h LEU 94 N 1.27 0.90 -0.73 1.55 3.38 -0.95 0.23 115.31 120.96 3inj h LEU 94 Ca 0.38 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 3inj h LEU 94 Cb -0.05 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 3inj h LEU 94 CO -0.11 1.04 -0.52 0.40 0.09 0.00 0.00 178.44 179.34 3inj h ILE 95 N 0.79 1.35 -0.30 1.22 2.04 -0.56 -2.47 117.51 119.58 3inj h ILE 95 Ca 0.12 -1.79 -0.09 0.00 1.00 0.00 0.00 64.86 64.11 3inj h ILE 95 Cb 0.69 1.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.60 3inj h ILE 95 CO 0.05 0.53 -0.16 -0.08 0.00 0.00 0.00 178.15 178.50 3inj h GLU 96 N 0.24 0.63 -0.97 2.37 4.81 -0.53 -0.64 114.58 120.47 3inj h GLU 96 Ca 0.01 -0.28 0.19 0.00 -0.13 0.00 0.00 59.36 59.14 3inj h GLU 96 Cb 1.00 -0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.27 3inj h GLU 96 CO 0.08 0.86 0.61 -0.09 -0.73 0.00 0.00 179.01 179.75 3inj h ARG 97 N 0.38 0.65 -0.50 1.92 2.43 -0.85 -1.52 114.38 116.89 3inj h ARG 97 Ca 0.06 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 58.97 3inj h ARG 97 Cb 0.68 -0.15 -0.14 0.00 -0.42 0.00 0.00 29.97 29.95 3inj h ARG 97 CO 0.05 0.43 0.11 -0.25 -1.51 0.00 0.00 179.97 178.79 3inj n ASP 98 N -4.66 3.10 -0.10 -3.80 8.00 -0.94 -4.72 116.55 113.43 3inj n ASP 98 Ca 0.22 -3.60 -0.09 0.00 0.71 0.00 0.00 54.79 52.02 3inj n ASP 98 Cb 0.60 -0.67 -0.02 0.00 -0.02 0.00 0.00 41.12 41.00 3inj n ASP 98 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 3inj h ARG 99 N 1.24 0.45 -0.11 -1.24 2.43 -0.02 -0.25 114.38 116.87 3inj h ARG 99 Ca 0.28 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.40 3inj h ARG 99 Cb 1.93 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 31.38 3inj h ARG 99 CO 0.54 0.41 0.01 1.15 -1.51 0.00 0.00 179.97 180.57 3inj h THR 100 N 0.38 0.94 -0.44 0.20 2.02 -1.84 -0.66 112.91 113.51 3inj h THR 100 Ca 0.11 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 3inj h THR 100 Cb 0.10 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 3inj h THR 100 CO -0.02 0.01 0.24 0.22 0.37 0.00 0.00 175.52 176.34 3inj h TYR 101 N 0.05 0.60 -0.44 3.16 3.20 -1.89 -2.44 116.97 119.22 3inj h TYR 101 Ca 0.05 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 3inj h TYR 101 Cb 0.05 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 3inj h TYR 101 CO -0.12 0.46 0.06 -0.07 -1.64 0.00 0.00 178.16 176.85 3inj h LEU 102 N 0.57 0.71 -1.14 2.82 3.38 -0.85 -0.71 115.31 120.10 3inj h LEU 102 Ca 0.15 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 3inj h LEU 102 Cb 0.06 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3inj h LEU 102 CO -0.02 0.80 0.35 0.00 0.09 0.00 0.00 178.44 179.66 3inj h ALA 103 N 0.93 1.33 -0.18 1.53 0.00 -1.08 0.12 119.26 121.92 3inj h ALA 103 Ca 0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3inj h ALA 103 Cb 0.40 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3inj h ALA 103 CO 0.01 0.53 0.01 0.00 0.00 0.00 0.00 179.25 179.80 3inj h ALA 104 N 1.43 0.24 -0.26 0.00 0.00 -1.18 -1.78 119.26 117.71 3inj h ALA 104 Ca 0.24 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3inj h ALA 104 Cb 0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3inj h ALA 104 CO -0.04 -0.07 0.15 1.25 0.00 0.00 0.00 179.25 180.55 3inj h LEU 105 N 0.08 0.24 -0.50 0.00 5.85 -0.74 0.63 115.31 120.87 3inj h LEU 105 Ca 0.05 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.87 3inj h LEU 105 Cb 0.35 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.25 3inj h LEU 105 CO 0.01 0.18 0.01 -0.08 -0.34 0.00 0.00 178.44 178.22 3inj h GLU 106 N 0.31 0.13 -0.73 1.25 4.57 -0.74 -1.46 114.58 117.90 3inj h GLU 106 Ca 0.10 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 58.21 3inj h GLU 106 Cb -0.01 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 3inj h GLU 106 CO -0.04 0.08 0.23 1.15 -1.18 0.00 0.00 179.01 179.25 3inj h THR 107 N 0.13 1.26 -0.69 0.32 2.02 -0.55 -0.42 112.91 114.97 3inj h THR 107 Ca 0.25 -0.91 -0.05 0.00 0.77 0.00 0.00 66.41 66.48 3inj h THR 107 Cb 0.37 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 3inj h THR 107 CO -0.40 0.36 0.25 0.25 0.37 0.00 0.00 175.52 176.35 3inj h LEU 108 N 1.09 0.98 0.00 2.58 5.85 -0.29 -1.85 115.31 123.67 3inj h LEU 108 Ca 0.24 -0.19 -0.25 0.00 0.84 0.00 0.00 57.88 58.52 3inj h LEU 108 Cb 0.31 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3inj h LEU 108 CO -0.01 0.90 -1.41 -0.78 -0.34 0.00 0.00 178.44 176.80 3inj h ASP 109 N 1.00 0.00 0.00 1.25 3.58 -1.12 -3.39 116.42 117.74 3inj h ASP 109 Ca 0.23 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.43 3inj h ASP 109 Cb 0.24 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 3inj h ASP 109 CO -0.01 0.98 -1.92 -3.20 -2.88 0.00 0.00 179.24 172.20 3inj n ASN 110 N -3.16 2.38 0.00 2.28 2.85 -0.18 -4.56 115.26 114.87 3inj n ASN 110 Ca -0.10 -0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.31 3inj n ASN 110 Cb 1.00 0.13 0.00 0.00 1.24 0.00 0.00 39.78 42.15 3inj n ASN 110 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3inj n GLY 111 N 2.52 2.16 3.78 8.20 0.00 -0.70 -4.49 105.19 116.68 3inj n GLY 111 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 3inj n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3inj s LYS 112 N -0.47 3.42 0.23 1.61 -2.85 -1.26 -3.86 119.74 116.56 3inj s LYS 112 Ca 0.00 1.49 -0.31 0.00 -1.00 0.00 0.00 55.97 56.15 3inj s LYS 112 Cb 0.00 -2.03 -0.14 0.00 -2.06 0.00 0.00 37.83 33.61 3inj s LYS 112 CO 0.00 -0.77 1.34 -2.30 0.10 0.00 0.00 175.35 173.72 3inj n PRO 113 N -1.37 1.84 -0.32 1.78 -0.02 -1.26 -4.52 135.00 131.13 3inj n PRO 113 Ca 0.11 0.65 0.05 0.00 -2.02 0.00 0.00 63.50 62.29 3inj n PRO 113 Cb 0.52 -2.26 0.24 0.00 -0.02 0.00 0.00 33.50 31.97 3inj n PRO 113 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3inj h TYR 114 N 3.87 1.07 -0.95 6.00 3.20 -0.94 -1.07 116.97 128.15 3inj h TYR 114 Ca -0.44 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.48 3inj h TYR 114 Cb 1.29 -0.35 -0.05 0.00 1.54 0.00 0.00 36.73 39.16 3inj h TYR 114 CO 0.55 0.53 0.62 0.28 -1.64 0.00 0.00 178.16 178.51 3inj h VAL 115 N 1.03 1.19 -0.16 1.81 2.07 -1.90 0.12 116.25 120.41 3inj h VAL 115 Ca 0.41 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 67.40 3inj h VAL 115 Cb 0.27 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 3inj h VAL 115 CO -0.17 0.23 -0.32 0.40 0.02 0.00 0.00 177.57 177.72 3inj h ILE 116 N 1.24 1.35 -0.85 4.57 1.08 -1.63 -0.59 117.51 122.68 3inj h ILE 116 Ca 0.37 -1.58 0.17 0.00 -0.39 0.00 0.00 64.86 63.43 3inj h ILE 116 Cb -0.06 1.97 -0.11 0.00 -3.07 0.00 0.00 36.82 35.56 3inj h ILE 116 CO -0.10 0.48 0.38 0.28 -0.69 0.00 0.00 178.15 178.50 3inj h SER 117 N 0.12 0.39 0.01 1.72 0.02 -0.87 0.68 113.55 115.61 3inj h SER 117 Ca 0.00 0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 60.94 3inj h SER 117 Cb 0.92 0.08 0.01 0.00 0.14 0.00 0.00 62.40 63.55 3inj h SER 117 CO 0.07 0.11 -0.55 0.22 -1.14 0.00 0.00 176.83 175.54 3inj h TYR 118 N 0.49 0.54 0.01 3.45 3.20 -0.79 -0.32 116.97 123.55 3inj h TYR 118 Ca 0.49 -0.30 -0.31 0.00 3.14 0.00 0.00 58.73 61.75 3inj h TYR 118 Cb 0.81 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.97 3inj h TYR 118 CO -0.13 1.12 -1.86 1.28 -1.64 0.00 0.00 178.16 176.93 3inj n LEU 119 N -4.27 0.90 0.00 2.82 4.77 -0.25 -4.02 117.00 116.96 3inj n LEU 119 Ca -0.10 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 3inj n LEU 119 Cb 0.65 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 3inj n LEU 119 CO 0.45 0.45 0.00 0.52 -1.33 0.00 0.00 177.39 177.49 3inj n VAL 120 N -3.03 0.00 -0.15 4.08 0.31 0.19 -4.26 118.33 115.46 3inj n VAL 120 Ca -0.21 0.16 -0.12 0.00 -0.01 0.00 0.00 64.34 64.16 3inj n VAL 120 Cb 1.07 -1.13 -0.07 0.00 -0.91 0.00 0.00 33.84 32.79 3inj n VAL 120 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3inj h ASP 121 N 0.00 -1.67 0.59 4.52 3.45 -1.48 0.16 116.42 121.99 3inj h ASP 121 Ca 0.00 0.24 -0.08 0.00 0.43 0.00 0.00 57.03 57.62 3inj h ASP 121 Cb 0.00 0.71 -0.01 0.00 -0.56 0.00 0.00 39.33 39.47 3inj h ASP 121 CO 0.00 -0.38 -0.37 -0.07 -1.57 0.00 0.00 179.24 176.85 3inj h LEU 122 N -0.34 0.00 -0.39 1.55 4.07 -1.23 0.09 115.31 119.06 3inj h LEU 122 Ca 0.11 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.91 3inj h LEU 122 Cb 0.59 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 3inj h LEU 122 CO -0.61 0.37 -0.38 -0.78 -1.08 0.00 0.00 178.44 175.95 3inj h ASP 123 N 0.00 1.01 0.16 -0.43 3.58 -1.46 -2.22 116.42 117.06 3inj h ASP 123 Ca -0.00 -0.46 -0.13 0.00 0.42 0.00 0.00 57.03 56.86 3inj h ASP 123 Cb 0.76 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 3inj h ASP 123 CO 0.05 1.27 -0.45 0.24 -2.88 0.00 0.00 179.24 177.46 3inj h MET 124 N 0.77 0.36 0.05 0.28 2.86 -0.21 -1.33 114.93 117.71 3inj h MET 124 Ca 0.06 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 3inj h MET 124 Cb 0.98 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.65 3inj h MET 124 CO 0.10 0.74 -0.02 0.28 1.06 0.00 0.00 176.91 179.07 3inj h VAL 125 N 0.29 0.98 -0.40 -2.22 2.07 -0.91 -0.43 116.25 115.64 3inj h VAL 125 Ca 0.02 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.48 3inj h VAL 125 Cb 0.91 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 3inj h VAL 125 CO 0.08 0.02 0.22 -0.07 0.02 0.00 0.00 177.57 177.84 3inj h LEU 126 N -0.10 0.34 -0.55 2.57 3.38 -1.28 -1.72 115.31 117.95 3inj h LEU 126 Ca -0.01 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3inj h LEU 126 Cb 0.08 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3inj h LEU 126 CO 0.01 0.25 0.09 0.11 0.09 0.00 0.00 178.44 178.98 3inj h LYS 127 N 0.44 0.91 0.20 1.13 1.57 -1.17 -0.32 116.57 119.33 3inj h LYS 127 Ca 0.16 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 3inj h LYS 127 Cb 0.04 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3inj h LYS 127 CO -0.09 0.88 -0.10 0.00 -0.57 0.00 0.00 179.45 179.57 3inj h LEU 129 N -0.29 0.85 -0.71 0.00 3.38 -1.24 -1.88 115.31 115.41 3inj h LEU 129 Ca -0.03 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.69 3inj h LEU 129 Cb 0.23 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3inj h LEU 129 CO 0.04 0.75 -0.19 0.03 0.09 0.00 0.00 178.44 179.17 3inj h ARG 130 N 0.89 0.79 0.38 1.13 3.08 -0.90 0.22 114.38 119.97 3inj h ARG 130 Ca 0.22 -0.30 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 3inj h ARG 130 Cb 0.14 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 3inj h ARG 130 CO -0.03 0.92 -0.35 -0.92 -1.07 0.00 0.00 179.97 178.53 3inj h TYR 131 N 0.70 -0.94 0.00 3.04 3.20 -0.33 -3.14 116.97 119.51 3inj h TYR 131 Ca 0.10 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 3inj h TYR 131 Cb 0.70 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 3inj h TYR 131 CO 0.04 -0.50 -0.30 1.88 -1.64 0.00 0.00 178.16 177.64 3inj h TYR 132 N -0.74 0.00 -0.96 -3.82 -1.99 -1.15 -0.65 116.97 107.67 3inj h TYR 132 Ca -0.03 0.00 0.14 0.00 2.00 0.00 0.00 58.73 60.84 3inj h TYR 132 Cb 0.66 0.00 -0.08 0.00 2.00 0.00 0.00 36.73 39.31 3inj h TYR 132 CO -0.19 0.30 0.61 0.00 -0.00 0.00 0.00 178.16 178.88 3inj h ALA 133 N 1.70 1.67 0.00 3.88 0.00 -0.91 -0.73 119.26 124.87 3inj h ALA 133 Ca -0.00 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3inj h ALA 133 Cb 0.60 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3inj h ALA 133 CO 0.04 0.07 -0.18 0.78 0.00 0.00 0.00 179.25 179.96 3inj h GLY 134 N 0.84 0.00 1.74 0.00 0.00 -1.07 -3.04 103.07 101.54 3inj h GLY 134 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 3inj h GLY 134 CO -0.25 0.00 -0.22 1.49 0.00 0.00 0.00 176.54 177.56 3inj h TRP 135 N 0.00 0.00 -0.92 5.60 -0.00 -1.11 -3.39 115.95 116.13 3inj h TRP 135 Ca -0.00 0.00 0.18 0.00 -0.00 0.00 0.00 58.89 59.07 3inj h TRP 135 Cb 0.58 0.00 -0.11 0.00 -0.00 0.00 0.00 29.16 29.64 3inj h TRP 135 CO 0.00 0.00 0.50 0.00 -0.00 0.00 0.00 178.44 178.94 3inj h ALA 136 N 2.27 1.47 -0.30 1.49 0.00 -1.40 -2.04 119.26 120.75 3inj h ALA 136 Ca 0.00 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3inj h ALA 136 Cb 0.87 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 3inj h ALA 136 CO 0.00 -0.13 -0.04 -0.40 0.00 0.00 0.00 179.25 178.68 3inj n ASP 137 N -4.86 2.98 0.00 0.00 3.85 -1.26 -4.64 116.55 112.62 3inj n ASP 137 Ca 0.21 -3.45 0.00 0.00 -0.71 0.00 0.00 54.79 50.84 3inj n ASP 137 Cb 0.54 -0.59 0.00 0.00 -1.35 0.00 0.00 41.12 39.72 3inj n ASP 137 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3inj n LYS 138 N -0.93 -0.01 -2.52 0.11 5.02 -0.77 -4.91 118.16 114.16 3inj n LYS 138 Ca 0.28 -0.22 -0.43 0.00 -2.02 0.00 0.00 58.31 55.92 3inj n LYS 138 Cb 0.96 -0.68 0.00 0.00 -0.02 0.00 0.00 35.03 35.29 3inj n LYS 138 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3inj n TYR 139 N -0.06 3.45 -1.94 2.13 9.36 -1.22 -5.00 117.16 123.88 3inj n TYR 139 Ca 0.00 -2.94 -0.38 0.00 3.32 0.00 0.00 57.90 57.91 3inj n TYR 139 Cb 0.11 -1.99 0.03 0.00 -0.63 0.00 0.00 39.34 36.87 3inj n TYR 139 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3inj s HIS 140 N 0.57 2.44 0.00 2.98 3.76 -1.26 -4.81 115.29 118.96 3inj s HIS 140 Ca 0.40 1.45 0.00 0.00 -0.15 0.00 0.00 55.06 56.76 3inj s HIS 140 Cb 0.06 -3.63 0.00 0.00 1.11 0.00 0.00 32.58 30.12 3inj s HIS 140 CO 0.01 -2.43 0.00 0.41 -0.85 0.00 0.00 174.74 171.87 3inj n GLY 141 N 0.63 -0.62 3.09 -2.22 0.00 -1.26 -4.90 105.19 99.91 3inj n GLY 141 Ca 0.11 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.28 3inj n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3inj s LYS 142 N -0.50 0.72 -0.15 1.61 1.02 -1.21 -4.94 119.74 116.29 3inj s LYS 142 Ca 0.00 -0.68 -0.12 0.00 0.02 0.00 0.00 55.97 55.19 3inj s LYS 142 Cb 0.00 -0.66 -0.05 0.00 -0.52 0.00 0.00 37.83 36.61 3inj s LYS 142 CO 0.00 0.16 0.24 0.95 -0.92 0.00 0.00 175.35 175.77 3inj s THR 143 N -0.93 5.34 -0.14 2.17 -4.23 -1.26 -0.42 115.64 116.17 3inj s THR 143 Ca -0.02 0.43 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 3inj s THR 143 Cb -0.08 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 70.22 3inj s THR 143 CO 0.01 0.45 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.74 3inj s ILE 144 N 0.07 1.74 -1.53 2.99 1.01 0.21 -4.99 121.20 120.70 3inj s ILE 144 Ca 0.15 -0.76 -0.12 0.00 0.00 0.00 0.00 60.65 59.91 3inj s ILE 144 Cb -0.13 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.75 3inj s ILE 144 CO 0.03 0.49 2.52 -0.81 0.00 0.00 0.00 174.94 177.17 3inj n PRO 145 N 4.40 3.19 -1.95 2.79 -0.04 -1.26 -3.95 135.00 138.18 3inj n PRO 145 Ca -0.19 -2.44 -0.33 0.00 -0.04 0.00 0.00 63.50 60.50 3inj n PRO 145 Cb 0.51 -3.10 0.02 0.00 -0.04 0.00 0.00 33.50 30.89 3inj n PRO 145 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3inj s ILE 146 N 2.80 3.57 0.61 0.52 2.07 -1.26 -4.99 121.20 124.52 3inj s ILE 146 Ca 0.56 0.75 -0.19 0.00 -1.41 0.00 0.00 60.65 60.36 3inj s ILE 146 Cb 0.16 -3.27 -0.04 0.00 0.13 0.00 0.00 42.46 39.43 3inj s ILE 146 CO -0.08 -0.43 1.06 0.47 -1.91 0.00 0.00 174.94 174.05 3inj n ASP 147 N -2.13 1.15 0.00 4.50 9.92 -1.26 -4.77 116.55 123.96 3inj n ASP 147 Ca 0.09 0.82 0.00 0.00 -0.53 0.00 0.00 54.79 55.17 3inj n ASP 147 Cb 0.52 -1.44 0.00 0.00 -0.64 0.00 0.00 41.12 39.57 3inj n ASP 147 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3inj n GLY 148 N 1.18 -0.34 2.77 0.44 0.00 -1.26 -4.58 105.19 103.39 3inj n GLY 148 Ca 0.14 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.93 3inj n GLY 148 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3inj n ASP 149 N -0.75 4.14 -4.05 1.61 8.00 -1.26 -4.74 116.55 119.50 3inj n ASP 149 Ca 0.00 -2.90 -0.11 0.00 0.71 0.00 0.00 54.79 52.50 3inj n ASP 149 Cb 0.00 -1.62 -0.11 0.00 -0.02 0.00 0.00 41.12 39.37 3inj n ASP 149 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3inj s PHE 150 N 2.61 0.52 -0.28 1.24 0.40 -1.26 -1.71 117.98 119.50 3inj s PHE 150 Ca 0.45 -0.62 -0.06 0.00 -0.60 0.00 0.00 56.93 56.10 3inj s PHE 150 Cb 0.13 -0.33 0.00 0.00 0.51 0.00 0.00 43.02 43.33 3inj s PHE 150 CO -0.07 -0.16 0.06 0.12 0.70 0.00 0.00 175.22 175.87 3inj s PHE 151 N -1.94 3.11 -0.03 0.36 5.36 0.64 -4.79 117.98 120.69 3inj s PHE 151 Ca -0.08 -0.90 0.07 0.00 -0.96 0.00 0.00 56.93 55.07 3inj s PHE 151 Cb -0.06 -2.23 -0.02 0.00 -0.34 0.00 0.00 43.02 40.37 3inj s PHE 151 CO -0.02 -0.54 -0.26 0.45 -1.46 0.00 0.00 175.22 173.40 3inj s SER 152 N 1.51 3.03 0.20 6.13 0.15 -1.25 0.11 113.70 123.58 3inj s SER 152 Ca 0.04 -0.48 -0.12 0.00 0.70 0.00 0.00 55.95 56.08 3inj s SER 152 Cb -0.16 -0.49 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 3inj s SER 152 CO 0.02 0.29 0.42 -0.72 1.20 0.00 0.00 173.24 174.45 3inj s TYR 153 N -0.47 0.26 0.06 3.44 -0.85 -0.13 -0.62 117.35 119.04 3inj s TYR 153 Ca 0.06 -0.62 0.09 0.00 -0.52 0.00 0.00 57.07 56.08 3inj s TYR 153 Cb -0.11 0.14 -0.03 0.00 0.38 0.00 0.00 41.96 42.34 3inj s TYR 153 CO 0.00 -0.87 -0.23 0.95 -1.52 0.00 0.00 175.55 173.88 3inj s THR 154 N -3.96 2.44 -0.15 -3.49 -4.23 0.43 -0.16 115.64 106.52 3inj s THR 154 Ca 0.17 -1.39 -0.05 0.00 -1.18 0.00 0.00 61.69 59.24 3inj s THR 154 Cb 0.01 -2.02 -0.03 0.00 1.34 0.00 0.00 72.50 71.80 3inj s THR 154 CO 0.03 0.29 0.01 -0.13 -0.54 0.00 0.00 174.62 174.27 3inj s ARG 155 N -1.52 3.69 -0.63 3.99 0.52 0.53 -3.35 118.95 122.18 3inj s ARG 155 Ca 0.14 -0.43 -0.21 0.00 -0.52 0.00 0.00 55.73 54.70 3inj s ARG 155 Cb -0.10 -3.01 0.09 0.00 0.52 0.00 0.00 34.95 32.44 3inj s ARG 155 CO 0.04 0.33 0.86 -1.01 0.02 0.00 0.00 175.30 175.54 3inj s HIS 156 N 0.17 2.82 0.31 -0.53 3.76 -1.26 -1.63 115.29 118.94 3inj s HIS 156 Ca 0.01 -0.74 0.04 0.00 -0.15 0.00 0.00 55.06 54.22 3inj s HIS 156 Cb -0.13 -4.17 -0.02 0.00 1.11 0.00 0.00 32.58 29.36 3inj s HIS 156 CO 0.02 -1.50 0.46 -1.21 -0.85 0.00 0.00 174.74 171.66 3inj s GLU 157 N 3.45 3.29 0.42 1.40 2.02 -0.06 -4.89 118.70 124.34 3inj s GLU 157 Ca 0.18 -0.74 -0.24 0.00 0.02 0.00 0.00 54.97 54.18 3inj s GLU 157 Cb -0.20 -2.79 -0.08 0.00 0.10 0.00 0.00 34.13 31.16 3inj s GLU 157 CO 0.08 0.18 1.16 -2.14 0.02 0.00 0.00 175.26 174.56 3inj s PRO 158 N -4.17 3.97 0.44 0.39 0.02 -1.26 0.66 135.00 135.06 3inj s PRO 158 Ca 0.40 1.80 0.14 0.00 0.02 0.00 0.00 61.00 63.36 3inj s PRO 158 Cb -0.09 -2.59 0.97 0.00 0.02 0.00 0.00 34.50 32.81 3inj s PRO 158 CO 0.32 -0.38 1.98 -0.24 -0.33 0.00 0.00 177.00 178.35 3inj h VAL 159 N 2.18 1.14 0.00 3.83 3.04 -1.82 -3.40 116.25 121.22 3inj h VAL 159 Ca -0.49 -0.65 0.00 0.00 -1.01 0.00 0.00 66.70 64.55 3inj h VAL 159 Cb 1.24 1.32 0.00 0.00 -2.01 0.00 0.00 31.29 31.84 3inj h VAL 159 CO 0.62 0.19 0.00 0.61 -1.01 0.00 0.00 177.57 177.98 3inj n GLY 160 N -0.99 0.27 3.63 3.17 0.00 -1.26 -4.87 105.19 105.14 3inj n GLY 160 Ca -0.02 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 3inj n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3inj s VAL 161 N 0.00 4.57 -0.23 1.61 1.01 -1.26 -2.39 120.40 123.70 3inj s VAL 161 Ca 0.00 1.58 -0.07 0.00 0.00 0.00 0.00 61.98 63.49 3inj s VAL 161 Cb 0.00 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 3inj s VAL 161 CO 0.00 -0.45 0.05 0.00 0.00 0.00 0.00 175.10 174.71 3inj s GLY 163 N 1.34 2.43 -0.11 0.00 0.00 0.24 -1.12 107.32 110.10 3inj s GLY 163 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 44.72 44.77 3inj s GLY 163 CO 0.03 1.20 -0.07 1.20 0.00 0.00 0.00 173.10 175.46 3inj s GLN 164 N 1.12 1.46 -0.27 2.90 -0.21 -0.52 -0.47 119.66 123.67 3inj s GLN 164 Ca 0.34 -0.23 -0.01 0.00 0.02 0.00 0.00 55.36 55.48 3inj s GLN 164 Cb -0.17 -1.54 0.04 0.00 1.00 0.00 0.00 33.01 32.35 3inj s GLN 164 CO 0.15 -0.26 -0.04 0.42 -2.12 0.00 0.00 175.29 173.44 3inj s ILE 165 N 1.70 2.81 0.08 1.08 1.01 -0.69 -0.21 121.20 126.98 3inj s ILE 165 Ca 0.05 -1.28 0.06 0.00 0.00 0.00 0.00 60.65 59.48 3inj s ILE 165 Cb -0.13 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 3inj s ILE 165 CO -0.08 0.03 -0.08 0.27 0.00 0.00 0.00 174.94 175.08 3inj s ILE 166 N 1.26 3.47 0.37 2.92 -4.36 -0.92 -1.98 121.20 121.96 3inj s ILE 166 Ca -0.04 -1.15 -0.05 0.00 -0.26 0.00 0.00 60.65 59.15 3inj s ILE 166 Cb -0.19 -2.61 0.08 0.00 1.25 0.00 0.00 42.46 41.00 3inj s ILE 166 CO -0.03 0.17 0.50 -2.65 0.24 0.00 0.00 174.94 173.17 3inj n PRO 167 N 0.85 -0.29 0.01 0.37 -0.02 -1.24 -3.40 135.00 131.28 3inj n PRO 167 Ca -0.13 -0.91 0.09 0.00 -2.02 0.00 0.00 63.50 60.53 3inj n PRO 167 Cb 0.52 -0.48 -0.14 0.00 -0.02 0.00 0.00 33.50 33.39 3inj n PRO 167 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 3inj n TRP 168 N -2.53 0.21 -0.31 6.00 4.27 -1.26 -4.26 117.44 119.56 3inj n TRP 168 Ca 0.07 0.06 -0.01 0.00 -3.89 0.00 0.00 57.50 53.73 3inj n TRP 168 Cb 0.24 -0.63 0.16 0.00 -1.36 0.00 0.00 31.31 29.71 3inj n TRP 168 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 3inj h ASN 169 N 0.00 1.04 -2.30 -0.67 -1.07 -1.96 -3.27 115.58 107.35 3inj h ASN 169 Ca -0.04 -0.04 -0.59 0.00 0.07 0.00 0.00 56.30 55.71 3inj h ASN 169 Cb 1.09 -0.26 -0.40 0.00 -2.07 0.00 0.00 38.32 36.68 3inj h ASN 169 CO 0.00 0.77 -0.87 0.49 0.07 0.00 0.00 177.43 177.90 3inj n PHE 170 N -4.38 1.06 -0.04 4.14 3.01 -1.26 -5.01 117.46 114.98 3inj n PHE 170 Ca 0.10 -3.77 -0.12 0.00 1.01 0.00 0.00 57.45 54.67 3inj n PHE 170 Cb 0.03 -0.30 -0.06 0.00 -0.01 0.00 0.00 39.48 39.14 3inj n PHE 170 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 3inj h PRO 171 N 4.63 -0.45 -0.11 -1.08 0.11 -1.74 0.74 132.00 134.11 3inj h PRO 171 Ca 0.16 0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.14 3inj h PRO 171 Cb 0.81 0.10 0.01 0.00 0.11 0.00 0.00 31.00 32.03 3inj h PRO 171 CO 0.57 -0.30 -0.56 -0.07 -0.21 0.00 0.00 178.00 177.43 3inj h LEU 172 N -0.47 0.69 -0.33 2.35 3.38 -1.93 -2.84 115.31 116.17 3inj h LEU 172 Ca 0.08 -0.64 -0.07 0.00 0.09 0.00 0.00 57.88 57.34 3inj h LEU 172 Cb 0.63 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3inj h LEU 172 CO -0.45 1.22 -0.09 0.25 0.09 0.00 0.00 178.44 179.46 3inj h LEU 173 N 0.21 0.64 -1.41 1.67 5.85 -1.84 -2.16 115.31 118.28 3inj h LEU 173 Ca -0.04 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 3inj h LEU 173 Cb 1.21 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 3inj h LEU 173 CO 0.12 0.86 0.23 0.24 -0.34 0.00 0.00 178.44 179.54 3inj h MET 174 N 0.41 0.63 -0.73 1.25 2.86 -0.94 0.40 114.93 118.82 3inj h MET 174 Ca 0.08 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 3inj h MET 174 Cb 0.59 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 3inj h MET 174 CO 0.03 0.48 0.27 0.37 1.06 0.00 0.00 176.91 179.12 3inj h GLN 175 N 0.63 1.10 -0.22 1.72 4.15 -1.23 -2.81 115.11 118.46 3inj h GLN 175 Ca 0.16 -0.21 -0.17 0.00 0.77 0.00 0.00 58.65 59.20 3inj h GLN 175 Cb 0.06 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 27.57 3inj h GLN 175 CO -0.02 0.92 -0.54 0.00 -1.93 0.00 0.00 178.83 177.25 3inj h ALA 176 N 1.13 0.63 -0.54 3.38 0.00 -0.56 -0.16 119.26 123.15 3inj h ALA 176 Ca 0.24 -0.51 0.01 0.00 0.00 0.00 0.00 54.91 54.65 3inj h ALA 176 Cb 0.25 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3inj h ALA 176 CO -0.02 0.69 0.36 -1.49 0.00 0.00 0.00 179.25 178.79 3inj h TRP 177 N 0.50 0.67 0.01 0.00 4.06 -0.88 -1.24 115.95 119.07 3inj h TRP 177 Ca 0.01 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.94 3inj h TRP 177 Cb 1.11 -0.23 -0.00 0.00 -1.00 0.00 0.00 29.16 29.04 3inj h TRP 177 CO 0.05 0.42 -0.17 0.87 -3.56 0.00 0.00 178.44 176.06 3inj h LYS 178 N 0.72 0.02 -0.38 0.49 1.79 -1.35 -3.39 116.57 114.47 3inj h LYS 178 Ca 0.20 -0.04 -0.10 0.00 -2.18 0.00 0.00 60.65 58.53 3inj h LYS 178 Cb -0.07 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.58 3inj h LYS 178 CO -0.04 1.02 -0.19 -0.07 -1.08 0.00 0.00 179.45 179.09 3inj h LEU 179 N -0.95 0.73 0.27 2.94 3.38 -0.95 -3.00 115.31 117.72 3inj h LEU 179 Ca -0.04 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 3inj h LEU 179 Cb 1.07 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 3inj h LEU 179 CO -0.01 0.91 -0.32 1.23 0.09 0.00 0.00 178.44 180.35 3inj h GLY 180 N 0.98 -1.08 1.22 0.83 0.00 -1.42 -1.00 103.07 102.61 3inj h GLY 180 Ca 0.10 0.50 -0.11 0.00 0.00 0.00 0.00 47.33 47.82 3inj h GLY 180 CO 0.05 -0.34 -0.14 -0.56 0.00 0.00 0.00 176.54 175.55 3inj h PRO 181 N -0.60 0.90 -0.05 4.80 0.13 -1.76 -1.51 132.00 133.92 3inj h PRO 181 Ca -0.03 -0.34 -0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3inj h PRO 181 Cb 0.53 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.60 3inj h PRO 181 CO -0.06 0.98 0.03 0.00 -0.23 0.00 0.00 178.00 178.72 3inj h ALA 182 N 1.03 0.06 -0.03 -0.56 0.00 -1.50 -2.64 119.26 115.62 3inj h ALA 182 Ca 0.12 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 3inj h ALA 182 Cb 0.68 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3inj h ALA 182 CO 0.05 -0.41 -0.78 -0.07 0.00 0.00 0.00 179.25 178.04 3inj h LEU 183 N -0.00 0.32 -1.35 0.00 3.38 -1.19 -0.87 115.31 115.60 3inj h LEU 183 Ca 0.02 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 3inj h LEU 183 Cb 0.07 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3inj h LEU 183 CO -0.00 0.97 0.36 0.00 0.09 0.00 0.00 178.44 179.86 3inj h ALA 184 N 1.01 1.52 -0.57 1.53 0.00 -1.23 -2.25 119.26 119.27 3inj h ALA 184 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3inj h ALA 184 Cb 1.36 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3inj h ALA 184 CO 0.12 0.42 0.00 0.25 0.00 0.00 0.00 179.25 180.05 3inj n THR 185 N -4.42 1.17 -0.92 0.00 -2.24 -1.00 -4.31 114.28 102.56 3inj n THR 185 Ca 0.06 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 3inj n THR 185 Cb 0.07 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 3inj n THR 185 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3inj n GLY 186 N 1.22 0.47 3.82 3.38 0.00 -0.85 -4.03 105.19 109.20 3inj n GLY 186 Ca 0.21 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 3inj n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3inj s ASN 187 N -2.60 2.82 0.16 1.61 0.01 -0.34 -4.84 114.94 111.75 3inj s ASN 187 Ca 0.00 0.53 0.08 0.00 -0.71 0.00 0.00 52.86 52.76 3inj s ASN 187 Cb 0.00 -0.77 -0.04 0.00 0.41 0.00 0.00 41.25 40.85 3inj s ASN 187 CO 0.00 -2.94 -0.17 0.68 -1.51 0.00 0.00 177.10 173.16 3inj s VAL 188 N -3.54 1.71 0.02 1.60 -7.23 -1.01 -4.63 120.40 107.32 3inj s VAL 188 Ca 0.70 -1.89 0.05 0.00 -1.81 0.00 0.00 61.98 59.03 3inj s VAL 188 Cb -0.08 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 35.05 3inj s VAL 188 CO 0.53 -0.35 -0.15 -0.69 -0.31 0.00 0.00 175.10 174.13 3inj s VAL 189 N -2.13 1.22 -0.26 1.32 1.01 0.38 -0.62 120.40 121.33 3inj s VAL 189 Ca 0.15 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.24 3inj s VAL 189 Cb -0.05 -1.07 0.07 0.00 0.00 0.00 0.00 36.38 35.33 3inj s VAL 189 CO 0.06 0.16 0.00 -0.69 0.00 0.00 0.00 175.10 174.63 3inj s VAL 190 N -0.66 1.41 -0.15 2.92 1.01 -0.27 -1.67 120.40 122.98 3inj s VAL 190 Ca 0.04 -1.35 -0.05 0.00 0.00 0.00 0.00 61.98 60.62 3inj s VAL 190 Cb -0.07 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 3inj s VAL 190 CO 0.01 -0.30 0.01 -0.32 0.00 0.00 0.00 175.10 174.50 3inj s MET 191 N 1.42 3.67 -0.24 2.72 1.75 0.13 -1.44 119.30 127.31 3inj s MET 191 Ca 0.00 -0.42 -0.08 0.00 -1.25 0.00 0.00 55.69 53.94 3inj s MET 191 Cb -0.18 -3.02 -0.04 0.00 2.84 0.00 0.00 34.83 34.43 3inj s MET 191 CO -0.10 0.35 0.10 0.21 -0.65 0.00 0.00 175.02 174.93 3inj s LYS 192 N 0.11 3.82 0.22 4.11 2.36 0.71 -0.37 119.74 130.70 3inj s LYS 192 Ca 0.02 -0.40 0.05 0.00 -2.55 0.00 0.00 55.97 53.09 3inj s LYS 192 Cb -0.13 -3.39 -0.03 0.00 -1.05 0.00 0.00 37.83 33.23 3inj s LYS 192 CO 0.02 -0.07 0.33 0.14 1.55 0.00 0.00 175.35 177.32 3inj s VAL 193 N 1.34 5.21 0.23 4.02 -7.23 -1.25 -2.17 120.40 120.55 3inj s VAL 193 Ca 0.06 -0.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.97 3inj s VAL 193 Cb -0.15 -3.80 -0.09 0.00 0.56 0.00 0.00 36.38 32.90 3inj s VAL 193 CO 0.05 -0.29 1.29 0.00 -0.31 0.00 0.00 175.10 175.84 3inj s ALA 194 N -1.94 3.51 0.46 1.32 0.00 -1.22 -4.31 121.76 119.58 3inj s ALA 194 Ca 0.34 1.12 0.17 0.00 0.00 0.00 0.00 51.96 53.58 3inj s ALA 194 Cb -0.09 -3.47 1.13 0.00 0.00 0.00 0.00 23.12 20.69 3inj s ALA 194 CO 0.29 -0.52 1.98 1.05 0.00 0.00 0.00 175.76 178.56 3inj h GLU 195 N 4.89 0.29 -0.06 0.00 4.11 -1.94 -0.43 114.58 121.43 3inj h GLU 195 Ca -0.46 -0.02 -0.12 0.00 0.07 0.00 0.00 59.36 58.84 3inj h GLU 195 Cb 1.22 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 3inj h GLU 195 CO 0.74 0.19 -0.49 1.96 0.07 0.00 0.00 179.01 181.49 3inj h GLN 196 N 0.30 0.16 -1.73 1.06 7.50 -1.94 -3.39 115.11 117.07 3inj h GLN 196 Ca 0.27 -0.09 -0.46 0.00 0.50 0.00 0.00 58.65 58.87 3inj h GLN 196 Cb 0.66 0.00 -0.36 0.00 0.05 0.00 0.00 27.48 27.83 3inj h GLN 196 CO -0.06 0.61 -1.08 0.25 -1.50 0.00 0.00 178.83 177.05 3inj n THR 197 N -3.96 -0.25 0.16 -0.54 -2.24 -0.23 -4.67 114.28 102.55 3inj n THR 197 Ca -0.02 -4.05 0.09 0.00 -2.27 0.00 0.00 64.05 57.80 3inj n THR 197 Cb 0.52 -0.36 0.07 0.00 -2.10 0.00 0.00 70.33 68.46 3inj n THR 197 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3inj h PRO 198 N 3.24 0.00 -0.22 -0.78 0.11 -1.61 -3.41 132.00 129.33 3inj h PRO 198 Ca 0.06 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 3inj h PRO 198 Cb 0.97 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 3inj h PRO 198 CO 0.45 0.14 0.06 -0.07 -0.21 0.00 0.00 178.00 178.36 3inj h LEU 199 N 0.00 0.33 -0.47 2.35 3.38 -1.89 -2.42 115.31 116.59 3inj h LEU 199 Ca -0.02 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.62 3inj h LEU 199 Cb 1.14 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 3inj h LEU 199 CO 0.02 0.47 -0.12 0.71 0.09 0.00 0.00 178.44 179.61 3inj h THR 200 N 0.18 1.27 -0.33 0.22 1.35 -1.91 -1.73 112.91 111.97 3inj h THR 200 Ca 0.07 -1.25 -0.06 0.00 -0.55 0.00 0.00 66.41 64.62 3inj h THR 200 Cb 0.26 1.10 -0.02 0.00 -1.73 0.00 0.00 68.15 67.77 3inj h THR 200 CO -0.00 0.43 -0.07 0.00 -0.25 0.00 0.00 175.52 175.63 3inj h ALA 201 N 0.88 1.27 -0.51 6.62 0.00 -1.83 -1.37 119.26 124.33 3inj h ALA 201 Ca 0.12 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 3inj h ALA 201 Cb 0.67 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3inj h ALA 201 CO 0.05 0.48 0.04 -0.07 0.00 0.00 0.00 179.25 179.75 3inj h LEU 202 N 0.50 0.84 -0.77 0.00 3.38 -1.00 -1.88 115.31 116.39 3inj h LEU 202 Ca 0.10 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 3inj h LEU 202 Cb 0.44 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3inj h LEU 202 CO 0.02 0.92 0.25 0.22 0.09 0.00 0.00 178.44 179.94 3inj h TYR 203 N 0.74 1.21 -0.01 1.13 3.20 -0.83 -1.99 116.97 120.43 3inj h TYR 203 Ca 0.15 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 3inj h TYR 203 Cb 0.46 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 3inj h TYR 203 CO 0.03 0.95 -0.10 0.28 -1.64 0.00 0.00 178.16 177.68 3inj h VAL 204 N 1.13 1.08 -0.38 1.81 2.07 -1.01 -0.14 116.25 120.80 3inj h VAL 204 Ca 0.25 -0.35 0.05 0.00 0.82 0.00 0.00 66.70 67.46 3inj h VAL 204 Cb 0.29 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 3inj h VAL 204 CO -0.01 0.10 0.11 0.00 0.02 0.00 0.00 177.57 177.79 3inj h ALA 205 N 1.89 0.43 -0.62 1.67 0.00 -0.57 0.25 119.26 122.31 3inj h ALA 205 Ca 0.00 0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.09 3inj h ALA 205 Cb 0.18 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.93 3inj h ALA 205 CO 0.01 -0.29 0.08 -0.91 0.00 0.00 0.00 179.25 178.15 3inj h ASN 206 N 0.25 -0.12 0.10 0.00 4.21 -0.88 -0.16 115.58 118.98 3inj h ASN 206 Ca 0.18 0.13 -0.09 0.00 1.21 0.00 0.00 56.30 57.74 3inj h ASN 206 Cb 0.18 0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.58 3inj h ASN 206 CO -0.20 -0.05 -0.28 -0.07 -1.29 0.00 0.00 177.43 175.53 3inj h LEU 207 N 0.19 0.30 -0.61 1.61 3.38 -0.84 0.60 115.31 119.95 3inj h LEU 207 Ca 0.33 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 3inj h LEU 207 Cb 0.53 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3inj h LEU 207 CO -0.47 0.58 0.25 0.40 0.09 0.00 0.00 178.44 179.28 3inj h ILE 208 N 0.26 1.23 -0.44 1.22 2.04 0.58 0.19 117.51 122.60 3inj h ILE 208 Ca 0.04 -0.71 0.01 0.00 1.00 0.00 0.00 64.86 65.19 3inj h ILE 208 Cb 0.64 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3inj h ILE 208 CO 0.05 0.28 0.28 0.50 0.00 0.00 0.00 178.15 179.25 3inj h LYS 209 N 0.85 0.55 -0.51 2.37 3.64 -0.33 -2.86 116.57 120.28 3inj h LYS 209 Ca 0.20 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 3inj h LYS 209 Cb 0.20 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3inj h LYS 209 CO -0.02 0.36 0.09 1.49 -2.27 0.00 0.00 179.45 179.10 3inj h GLU 210 N 0.57 0.80 0.00 1.90 4.81 -0.32 -2.67 114.58 119.67 3inj h GLU 210 Ca 0.17 -0.18 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 3inj h GLU 210 Cb -0.04 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 3inj h GLU 210 CO -0.05 0.75 -0.18 0.00 -0.73 0.00 0.00 179.01 178.80 3inj h ALA 211 N 1.33 1.62 0.00 2.92 0.00 -0.41 -3.46 119.26 121.25 3inj h ALA 211 Ca 0.16 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3inj h ALA 211 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3inj h ALA 211 CO 0.00 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.88 3inj n GLY 212 N -0.95 1.31 3.71 0.00 0.00 -1.01 -4.95 105.19 103.31 3inj n GLY 212 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3inj n GLY 212 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3inj s PHE 213 N -2.00 2.99 0.42 1.61 0.40 -1.18 -4.94 117.98 115.28 3inj s PHE 213 Ca 0.00 0.62 -0.23 0.00 -0.60 0.00 0.00 56.93 56.71 3inj s PHE 213 Cb 0.00 -3.91 -0.12 0.00 0.51 0.00 0.00 43.02 39.50 3inj s PHE 213 CO 0.00 -3.38 0.76 -2.30 0.70 0.00 0.00 175.22 171.00 3inj n PRO 214 N 4.19 0.89 -1.78 0.24 -0.02 -1.26 -4.84 135.00 132.42 3inj n PRO 214 Ca 0.14 0.32 -0.41 0.00 -2.02 0.00 0.00 63.50 61.53 3inj n PRO 214 Cb 0.39 -1.74 -0.00 0.00 -0.02 0.00 0.00 33.50 32.13 3inj n PRO 214 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3inj s PRO 215 N -1.78 4.09 0.00 0.52 0.02 -1.26 -2.63 135.00 133.96 3inj s PRO 215 Ca 0.64 2.60 0.00 0.00 0.02 0.00 0.00 61.00 64.26 3inj s PRO 215 Cb -0.59 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 30.96 3inj s PRO 215 CO 0.57 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 177.08 3inj n GLY 216 N 0.65 3.32 0.28 0.52 0.00 -1.26 -4.72 105.19 103.97 3inj n GLY 216 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3inj n GLY 216 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3inj h VAL 217 N 0.00 1.27 -3.33 1.61 2.07 -1.81 -3.31 116.25 112.75 3inj h VAL 217 Ca 0.00 -1.37 -0.55 0.00 0.82 0.00 0.00 66.70 65.60 3inj h VAL 217 Cb 0.00 1.16 -0.34 0.00 -1.52 0.00 0.00 31.29 30.59 3inj h VAL 217 CO 0.00 0.47 -0.82 -0.69 0.02 0.00 0.00 177.57 176.54 3inj s VAL 218 N -4.64 1.31 -0.04 2.57 1.01 -1.26 -0.47 120.40 118.88 3inj s VAL 218 Ca -0.10 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.35 3inj s VAL 218 Cb 0.13 -1.21 0.01 0.00 0.00 0.00 0.00 36.38 35.31 3inj s VAL 218 CO 0.86 0.40 -0.10 0.20 0.00 0.00 0.00 175.10 176.46 3inj s ASN 219 N 0.88 1.39 -0.13 3.32 0.01 -0.67 -4.67 114.94 115.06 3inj s ASN 219 Ca -0.10 -0.22 0.00 0.00 -0.71 0.00 0.00 52.86 51.84 3inj s ASN 219 Cb -0.15 -0.45 0.02 0.00 0.41 0.00 0.00 41.25 41.08 3inj s ASN 219 CO 0.01 0.06 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.90 3inj s ILE 220 N 0.32 1.44 -0.46 0.60 1.01 -0.56 0.21 121.20 123.75 3inj s ILE 220 Ca -0.06 -0.56 -0.00 0.00 0.00 0.00 0.00 60.65 60.03 3inj s ILE 220 Cb -0.11 -1.37 0.12 0.00 0.01 0.00 0.00 42.46 41.12 3inj s ILE 220 CO 0.01 0.44 0.24 -0.69 0.00 0.00 0.00 174.94 174.93 3inj s VAL 221 N 1.46 3.05 0.69 2.92 1.01 0.51 -1.74 120.40 128.29 3inj s VAL 221 Ca 0.03 -2.55 -0.17 0.00 0.00 0.00 0.00 61.98 59.30 3inj s VAL 221 Cb -0.13 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 3inj s VAL 221 CO -0.09 -0.73 0.87 -2.65 0.00 0.00 0.00 175.10 172.50 3inj n PRO 222 N 4.00 0.56 -2.59 2.72 -0.02 -1.26 -3.96 135.00 134.45 3inj n PRO 222 Ca 0.03 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3inj n PRO 222 Cb 0.39 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 3inj n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3inj n GLY 223 N 1.27 -1.03 3.99 -1.23 0.00 -1.26 -0.40 105.19 106.52 3inj n GLY 223 Ca 0.13 -1.51 -0.19 0.00 0.00 0.00 0.00 46.02 44.45 3inj n GLY 223 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3inj s PHE 224 N -2.17 3.09 0.01 1.61 2.99 -1.26 -4.05 117.98 118.20 3inj s PHE 224 Ca 0.00 -0.20 -0.25 0.00 0.00 0.00 0.00 56.93 56.48 3inj s PHE 224 Cb 0.00 -2.07 -0.15 0.00 0.00 0.00 0.00 43.02 40.80 3inj s PHE 224 CO 0.00 -0.09 1.12 0.78 -0.00 0.00 0.00 175.22 177.04 3inj h GLY 225 N 0.82 -0.73 0.09 4.36 0.00 -1.95 0.15 103.07 105.81 3inj h GLY 225 Ca -0.45 0.27 0.22 0.00 0.00 0.00 0.00 47.33 47.37 3inj h GLY 225 CO 0.52 -0.26 0.74 -2.55 0.00 0.00 0.00 176.54 174.99 3inj h PRO 226 N -1.03 0.00 0.00 4.80 0.11 -1.96 -1.64 132.00 132.27 3inj h PRO 226 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3inj h PRO 226 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 3inj h PRO 226 CO 0.12 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.16 3inj n THR 227 N -3.73 0.00 -0.05 -1.15 -2.24 -1.16 -4.42 114.28 101.53 3inj n THR 227 Ca 0.16 0.19 -0.05 0.00 -2.27 0.00 0.00 64.05 62.07 3inj n THR 227 Cb 1.01 -1.13 0.15 0.00 -2.10 0.00 0.00 70.33 68.25 3inj n THR 227 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3inj h ALA 228 N -1.60 1.01 0.08 6.98 0.00 -0.78 -2.54 119.26 122.40 3inj h ALA 228 Ca 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3inj h ALA 228 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3inj h ALA 228 CO 0.00 0.59 -0.04 0.78 0.00 0.00 0.00 179.25 180.58 3inj h GLY 229 N 0.99 -0.11 1.67 0.00 0.00 -1.17 -2.63 103.07 101.80 3inj h GLY 229 Ca 0.09 0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 3inj h GLY 229 CO 0.05 -0.04 0.11 0.00 0.00 0.00 0.00 176.54 176.66 3inj h ALA 230 N 0.25 1.62 0.33 3.60 0.00 -1.39 -2.01 119.26 121.68 3inj h ALA 230 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3inj h ALA 230 Cb 0.49 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3inj h ALA 230 CO 0.02 0.30 -0.18 0.00 0.00 0.00 0.00 179.25 179.39 3inj h ALA 231 N 1.70 -0.47 -0.60 0.00 0.00 -1.44 -1.06 119.26 117.39 3inj h ALA 231 Ca 0.11 -0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.04 3inj h ALA 231 Cb 0.11 0.21 -0.09 0.00 0.00 0.00 0.00 17.79 18.01 3inj h ALA 231 CO -0.01 -0.77 0.09 0.82 0.00 0.00 0.00 179.25 179.38 3inj h ILE 232 N -0.48 0.59 -0.21 0.00 2.04 -1.08 -0.64 117.51 117.75 3inj h ILE 232 Ca -0.04 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.65 3inj h ILE 232 Cb 0.38 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3inj h ILE 232 CO 0.06 0.04 -0.31 0.00 0.00 0.00 0.00 178.15 177.94 3inj h ALA 233 N 1.50 1.09 -0.03 1.87 0.00 -1.14 -3.04 119.26 119.51 3inj h ALA 233 Ca 0.31 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3inj h ALA 233 Cb 0.49 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3inj h ALA 233 CO -0.44 0.57 -0.06 0.43 0.00 0.00 0.00 179.25 179.75 3inj n SER 234 N -4.09 2.57 -4.76 0.00 7.64 -0.42 -4.05 113.62 110.50 3inj n SER 234 Ca -0.01 -1.83 -0.41 0.00 1.01 0.00 0.00 58.87 57.64 3inj n SER 234 Cb 0.43 0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.67 3inj n SER 234 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3inj s HIS 235 N -2.06 3.03 -1.25 1.43 5.04 -0.29 -4.78 115.29 116.41 3inj s HIS 235 Ca 0.29 1.33 0.29 0.00 -1.54 0.00 0.00 55.06 55.43 3inj s HIS 235 Cb 0.20 -3.72 1.28 0.00 0.04 0.00 0.00 32.58 30.39 3inj s HIS 235 CO 0.34 -2.05 1.92 -1.91 -2.34 0.00 0.00 174.74 170.71 3inj n GLU 236 N 1.10 0.26 -0.03 2.88 4.07 -1.26 -3.42 120.64 124.23 3inj n GLU 236 Ca 0.01 -0.03 0.03 0.00 -0.06 0.00 0.00 57.16 57.11 3inj n GLU 236 Cb 0.41 -1.50 0.05 0.00 -0.06 0.00 0.00 31.44 30.34 3inj n GLU 236 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 3inj n ASP 237 N -1.34 1.85 -4.66 4.31 2.03 -1.26 -4.85 116.55 112.64 3inj n ASP 237 Ca 0.11 -1.49 -0.41 0.00 0.52 0.00 0.00 54.79 53.51 3inj n ASP 237 Cb 0.29 -0.04 -0.05 0.00 -0.72 0.00 0.00 41.12 40.61 3inj n ASP 237 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3inj s VAL 238 N -0.69 4.90 0.07 5.18 1.01 -1.22 -4.75 120.40 124.90 3inj s VAL 238 Ca 0.10 1.48 0.02 0.00 0.00 0.00 0.00 61.98 63.57 3inj s VAL 238 Cb 0.06 -4.07 -0.25 0.00 0.00 0.00 0.00 36.38 32.12 3inj s VAL 238 CO 0.09 0.01 1.09 0.44 0.00 0.00 0.00 175.10 176.73 3inj h ASP 239 N 7.52 0.23 -3.85 3.32 3.32 -1.48 -3.43 116.42 122.06 3inj h ASP 239 Ca -0.27 -0.27 -0.19 0.00 0.02 0.00 0.00 57.03 56.32 3inj h ASP 239 Cb 1.12 -0.07 -0.26 0.00 0.22 0.00 0.00 39.33 40.33 3inj h ASP 239 CO 0.83 1.22 -0.56 -0.75 -1.72 0.00 0.00 179.24 178.25 3inj s LYS 240 N -2.66 0.17 -0.07 3.56 2.36 -1.01 -1.50 119.74 120.59 3inj s LYS 240 Ca -0.03 0.15 0.03 0.00 -2.55 0.00 0.00 55.97 53.57 3inj s LYS 240 Cb 0.08 0.08 0.01 0.00 -1.05 0.00 0.00 37.83 36.95 3inj s LYS 240 CO 0.85 -0.02 -0.16 0.54 1.55 0.00 0.00 175.35 178.10 3inj s VAL 241 N -0.01 1.43 -0.15 4.02 0.11 0.25 0.79 120.40 126.84 3inj s VAL 241 Ca -0.01 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.38 3inj s VAL 241 Cb -0.01 -1.26 0.01 0.00 -1.53 0.00 0.00 36.38 33.58 3inj s VAL 241 CO 0.00 0.42 -0.18 0.00 -3.33 0.00 0.00 175.10 172.01 3inj s ALA 242 N 0.41 2.39 -0.10 1.54 0.00 0.38 -1.95 121.76 124.43 3inj s ALA 242 Ca -0.13 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.77 3inj s ALA 242 Cb -0.15 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 21.83 3inj s ALA 242 CO 0.05 -0.08 -0.16 0.12 0.00 0.00 0.00 175.76 175.69 3inj s PHE 243 N 0.89 1.94 -0.17 0.00 5.36 -0.85 -1.71 117.98 123.44 3inj s PHE 243 Ca -0.04 -0.86 -0.01 0.00 -0.96 0.00 0.00 56.93 55.06 3inj s PHE 243 Cb -0.15 -1.38 -0.00 0.00 -0.34 0.00 0.00 43.02 41.14 3inj s PHE 243 CO -0.02 -0.42 -0.13 0.99 -1.46 0.00 0.00 175.22 174.18 3inj s THR 244 N 0.82 2.84 -1.64 0.12 2.01 -0.84 -0.60 115.64 118.36 3inj s THR 244 Ca -0.10 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.20 3inj s THR 244 Cb -0.16 -2.22 0.00 0.00 0.01 0.00 0.00 72.50 70.13 3inj s THR 244 CO 0.01 0.50 0.00 0.61 -0.69 0.00 0.00 174.62 175.05 3inj n GLY 245 N 4.21 -0.58 3.78 4.40 0.00 -0.70 -3.68 105.19 112.62 3inj n GLY 245 Ca -0.19 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 3inj n GLY 245 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 246 N -4.00 5.22 0.49 1.61 1.04 -1.26 -3.74 113.70 113.06 3inj s SER 246 Ca 0.00 1.89 0.24 0.00 0.48 0.00 0.00 55.95 58.56 3inj s SER 246 Cb 0.00 -2.54 1.29 0.00 0.10 0.00 0.00 66.02 64.87 3inj s SER 246 CO 0.00 -1.55 2.03 0.74 0.98 0.00 0.00 173.24 175.44 3inj h THR 247 N -0.09 0.73 -0.51 2.02 2.02 -1.90 -2.52 112.91 112.66 3inj h THR 247 Ca -0.46 -0.62 -0.12 0.00 0.77 0.00 0.00 66.41 65.98 3inj h THR 247 Cb 1.23 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 69.00 3inj h THR 247 CO 0.55 0.15 -0.14 -0.33 0.37 0.00 0.00 175.52 176.12 3inj h GLU 248 N 0.00 0.98 0.00 6.66 5.08 -1.96 -3.10 114.58 122.24 3inj h GLU 248 Ca -0.00 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 3inj h GLU 248 Cb 0.36 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 3inj h GLU 248 CO 0.02 1.05 -0.57 0.82 -1.00 0.00 0.00 179.01 179.33 3inj h ILE 249 N 0.87 0.07 -0.12 3.13 1.08 -1.89 -3.20 117.51 117.45 3inj h ILE 249 Ca 0.13 -1.11 -0.05 0.00 -0.39 0.00 0.00 64.86 63.44 3inj h ILE 249 Cb 0.70 1.79 -0.01 0.00 -3.07 0.00 0.00 36.82 36.23 3inj h ILE 249 CO 0.05 0.04 -0.16 1.23 -0.69 0.00 0.00 178.15 178.62 3inj h GLY 250 N 3.96 0.20 0.70 5.37 0.00 -1.38 -1.53 103.07 110.40 3inj h GLY 250 Ca -0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 3inj h GLY 250 CO 0.01 0.12 -0.04 3.21 0.00 0.00 0.00 176.54 179.84 3inj h ARG 251 N 0.18 -0.10 -0.90 4.80 3.08 -1.54 -2.49 114.38 117.41 3inj h ARG 251 Ca 0.03 0.01 0.17 0.00 0.07 0.00 0.00 59.98 60.26 3inj h ARG 251 Cb 0.40 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.40 3inj h ARG 251 CO 0.03 0.20 0.58 0.28 -1.07 0.00 0.00 179.97 179.99 3inj h VAL 252 N -0.40 0.76 -0.20 2.04 2.07 -1.54 -1.86 116.25 117.11 3inj h VAL 252 Ca -0.01 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 3inj h VAL 252 Cb 0.34 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3inj h VAL 252 CO 0.02 0.11 -0.01 0.40 0.02 0.00 0.00 177.57 178.10 3inj h ILE 253 N 0.59 1.27 -0.00 4.57 1.08 -1.13 -1.36 117.51 122.52 3inj h ILE 253 Ca 0.47 -0.93 -0.14 0.00 -0.39 0.00 0.00 64.86 63.87 3inj h ILE 253 Cb 0.90 1.47 -0.02 0.00 -3.07 0.00 0.00 36.82 36.10 3inj h ILE 253 CO -0.21 0.28 -0.65 -0.61 -0.69 0.00 0.00 178.15 176.27 3inj h GLN 254 N 0.12 0.01 -0.09 2.37 4.15 -0.94 -2.07 115.11 118.67 3inj h GLN 254 Ca 0.06 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 3inj h GLN 254 Cb 0.43 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.12 3inj h GLN 254 CO 0.01 0.66 -0.30 0.28 -1.93 0.00 0.00 178.83 177.55 3inj h VAL 255 N 0.01 1.41 -1.00 2.39 2.07 -1.40 -1.82 116.25 117.91 3inj h VAL 255 Ca -0.01 -1.66 0.18 0.00 0.82 0.00 0.00 66.70 66.04 3inj h VAL 255 Cb 1.15 2.24 -0.10 0.00 -1.52 0.00 0.00 31.29 33.06 3inj h VAL 255 CO 0.09 0.48 0.62 0.00 0.02 0.00 0.00 177.57 178.77 3inj h ALA 256 N 0.46 1.71 -0.01 1.67 0.00 -1.11 0.19 119.26 122.18 3inj h ALA 256 Ca -0.01 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3inj h ALA 256 Cb 0.93 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3inj h ALA 256 CO 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 179.25 179.24 3inj h ALA 257 N 1.63 0.01 -0.93 0.00 0.00 -1.33 -1.82 119.26 116.82 3inj h ALA 257 Ca 0.56 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 55.28 3inj h ALA 257 Cb 0.88 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.60 3inj h ALA 257 CO -0.34 -0.19 0.60 0.78 0.00 0.00 0.00 179.25 180.09 3inj h GLY 258 N -0.55 1.39 1.04 0.00 0.00 -0.87 -1.69 103.07 102.40 3inj h GLY 258 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.94 3inj h GLY 258 CO 0.00 0.20 -0.13 1.44 0.00 0.00 0.00 176.54 178.05 3inj n SER 259 N -4.55 0.42 0.00 0.19 7.64 0.64 -4.52 113.62 113.43 3inj n SER 259 Ca 0.16 -0.42 0.00 0.00 1.01 0.00 0.00 58.87 59.62 3inj n SER 259 Cb 0.32 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 3inj n SER 259 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3inj n SER 260 N -1.07 0.00 -1.53 6.43 3.41 -0.69 -4.98 113.62 115.19 3inj n SER 260 Ca 0.13 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.81 3inj n SER 260 Cb 0.29 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 64.59 3inj n SER 260 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3inj n ASN 261 N 0.00 5.01 -3.46 4.04 6.94 -1.23 -4.93 115.26 121.63 3inj n ASN 261 Ca 0.00 -2.99 -0.25 0.00 -0.02 0.00 0.00 54.58 51.32 3inj n ASN 261 Cb 0.00 -0.64 0.03 0.00 -2.36 0.00 0.00 39.78 36.82 3inj n ASN 261 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3inj n LEU 262 N 0.15 -2.56 -4.69 -4.53 4.77 -0.72 -4.94 117.00 104.48 3inj n LEU 262 Ca 0.26 -0.50 -0.37 0.00 -0.03 0.00 0.00 56.01 55.37 3inj n LEU 262 Cb 1.10 -2.70 0.06 0.00 -2.33 0.00 0.00 43.42 39.55 3inj n LEU 262 CO 0.27 0.37 0.79 2.29 -1.33 0.00 0.00 177.39 179.78 3inj n LYS 263 N -4.36 1.10 -2.23 3.23 2.85 -1.26 -4.97 118.16 112.53 3inj n LYS 263 Ca -0.02 0.43 -0.36 0.00 -1.05 0.00 0.00 58.31 57.30 3inj n LYS 263 Cb 0.57 -2.41 0.00 0.00 -0.65 0.00 0.00 35.03 32.54 3inj n LYS 263 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 3inj s ARG 264 N -3.10 3.46 -0.03 -1.58 3.00 -0.56 -4.84 118.95 115.29 3inj s ARG 264 Ca 0.79 1.70 0.01 0.00 0.00 0.00 0.00 55.73 58.23 3inj s ARG 264 Cb -0.40 -2.14 0.02 0.00 0.00 0.00 0.00 34.95 32.44 3inj s ARG 264 CO 0.44 -0.79 -0.02 0.08 0.00 0.00 0.00 175.30 175.01 3inj s VAL 265 N -1.67 0.30 0.13 3.52 1.01 -1.26 -0.58 120.40 121.84 3inj s VAL 265 Ca 0.70 0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.79 3inj s VAL 265 Cb -0.26 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 3inj s VAL 265 CO 0.31 0.17 -0.24 0.42 0.00 0.00 0.00 175.10 175.76 3inj s THR 266 N 0.95 2.02 -0.02 3.92 -4.23 -0.82 -4.94 115.64 112.52 3inj s THR 266 Ca -0.11 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 3inj s THR 266 Cb -0.14 -1.82 0.02 0.00 1.34 0.00 0.00 72.50 71.89 3inj s THR 266 CO -0.01 -0.02 0.00 -0.76 -0.54 0.00 0.00 174.62 173.29 3inj s LEU 267 N -2.10 1.47 -0.21 4.79 1.43 -0.92 -2.01 118.68 121.13 3inj s LEU 267 Ca 0.12 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 3inj s LEU 267 Cb -0.09 -0.13 0.02 0.00 0.03 0.00 0.00 46.19 46.02 3inj s LEU 267 CO 0.06 -0.06 -0.14 -1.61 0.23 0.00 0.00 176.35 174.83 3inj s GLU 268 N 0.62 2.88 0.00 1.70 2.02 0.23 -1.12 118.70 125.04 3inj s GLU 268 Ca -0.06 -0.92 0.00 0.00 0.02 0.00 0.00 54.97 54.01 3inj s GLU 268 Cb -0.08 -2.77 0.00 0.00 0.10 0.00 0.00 34.13 31.38 3inj s GLU 268 CO -0.01 -0.31 0.00 1.28 0.02 0.00 0.00 175.26 176.24 3inj n LEU 269 N 4.62 0.00 0.00 1.80 4.77 0.76 -1.72 117.00 127.23 3inj n LEU 269 Ca -0.19 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.51 3inj n LEU 269 Cb 0.48 0.00 0.25 0.00 -2.33 0.00 0.00 43.42 41.82 3inj n LEU 269 CO 0.26 0.00 0.48 0.61 -1.33 0.00 0.00 177.39 177.41 3inj n GLY 270 N 3.63 -3.19 3.60 -0.72 0.00 -1.25 -4.85 105.19 102.41 3inj n GLY 270 Ca 0.00 -1.42 -0.07 0.00 0.00 0.00 0.00 46.02 44.53 3inj n GLY 270 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3inj s GLY 271 N -3.88 -0.39 -0.38 -0.02 0.00 -1.23 -4.36 107.32 97.06 3inj s GLY 271 Ca 0.65 0.54 0.11 0.00 0.00 0.00 0.00 44.72 46.02 3inj s GLY 271 CO 0.52 0.17 0.69 1.17 0.00 0.00 0.00 173.10 175.64 3inj n LYS 272 N -0.35 0.99 -2.06 2.90 3.00 -1.26 -4.52 118.16 116.85 3inj n LYS 272 Ca -0.09 -3.40 -0.42 0.00 -0.00 0.00 0.00 58.31 54.41 3inj n LYS 272 Cb 0.62 -1.61 -0.03 0.00 0.00 0.00 0.00 35.03 34.01 3inj n LYS 272 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 3inj s SER 273 N -2.17 6.71 -0.01 3.14 0.01 -1.22 -4.63 113.70 115.54 3inj s SER 273 Ca 0.39 2.55 -0.26 0.00 1.31 0.00 0.00 55.95 59.94 3inj s SER 273 Cb 0.30 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 3inj s SER 273 CO -0.09 -0.69 0.79 -2.16 0.41 0.00 0.00 173.24 171.51 3inj s PRO 274 N 0.24 4.49 -0.35 12.44 0.04 -1.25 -2.16 135.00 148.45 3inj s PRO 274 Ca 0.62 1.08 -0.03 0.00 0.04 0.00 0.00 61.00 62.71 3inj s PRO 274 Cb -0.40 -3.42 0.07 0.00 0.04 0.00 0.00 34.50 30.79 3inj s PRO 274 CO 0.38 0.12 0.10 1.21 0.04 0.00 0.00 177.00 178.85 3inj s ASN 275 N 0.51 5.10 -0.30 6.66 3.04 0.16 -0.89 114.94 129.23 3inj s ASN 275 Ca 0.41 -1.56 -0.13 0.00 0.04 0.00 0.00 52.86 51.63 3inj s ASN 275 Cb -0.20 -1.78 -0.03 0.00 -1.54 0.00 0.00 41.25 37.70 3inj s ASN 275 CO 0.22 -0.38 0.27 -0.63 -3.04 0.00 0.00 177.10 173.53 3inj s ILE 276 N 1.23 5.25 -0.43 -5.21 1.01 0.41 -0.57 121.20 122.89 3inj s ILE 276 Ca 0.01 0.15 -0.10 0.00 0.00 0.00 0.00 60.65 60.70 3inj s ILE 276 Cb -0.21 -3.65 0.08 0.00 0.01 0.00 0.00 42.46 38.69 3inj s ILE 276 CO -0.02 0.12 0.29 -0.63 0.00 0.00 0.00 174.94 174.70 3inj s ILE 277 N 1.86 4.42 0.70 2.92 -1.09 0.15 -0.53 121.20 129.62 3inj s ILE 277 Ca 0.09 -1.35 -0.13 0.00 -2.23 0.00 0.00 60.65 57.03 3inj s ILE 277 Cb -0.16 -3.70 0.02 0.00 -1.58 0.00 0.00 42.46 37.04 3inj s ILE 277 CO 0.11 -0.53 1.10 -0.04 -1.23 0.00 0.00 174.94 174.34 3inj s MET 278 N 1.46 2.62 0.46 2.79 -1.94 -0.88 -1.71 119.30 122.11 3inj s MET 278 Ca 0.03 1.28 0.31 0.00 -1.71 0.00 0.00 55.69 55.60 3inj s MET 278 Cb -0.23 -1.94 1.33 0.00 2.01 0.00 0.00 34.83 36.00 3inj s MET 278 CO 0.03 -1.38 1.92 0.66 -0.01 0.00 0.00 175.02 176.24 3inj h SER 279 N -0.43 0.00 -0.45 3.03 4.64 -1.89 -2.37 113.55 116.09 3inj h SER 279 Ca -0.45 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.79 3inj h SER 279 Cb 1.24 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 3inj h SER 279 CO 0.53 0.00 0.10 -0.90 -0.87 0.00 0.00 176.83 175.70 3inj n ASP 280 N -2.79 4.00 -4.82 4.97 5.75 -1.26 -4.92 116.55 117.48 3inj n ASP 280 Ca 0.01 -2.72 -0.33 0.00 -0.01 0.00 0.00 54.79 51.73 3inj n ASP 280 Cb 0.25 -0.65 -0.07 0.00 -1.03 0.00 0.00 41.12 39.63 3inj n ASP 280 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3inj s ALA 281 N -2.18 3.09 -0.31 2.12 0.00 -0.89 -3.29 121.76 120.30 3inj s ALA 281 Ca 0.37 0.36 -0.28 0.00 0.00 0.00 0.00 51.96 52.41 3inj s ALA 281 Cb 0.29 -3.10 -0.03 0.00 0.00 0.00 0.00 23.12 20.27 3inj s ALA 281 CO 0.10 0.16 2.00 0.34 0.00 0.00 0.00 175.76 178.35 3inj s ASP 282 N -2.14 5.61 0.10 0.00 3.68 -1.26 -4.90 116.67 117.75 3inj s ASP 282 Ca 0.60 1.47 -0.30 0.00 2.13 0.00 0.00 52.55 56.45 3inj s ASP 282 Cb -0.10 -2.52 -0.11 0.00 -1.45 0.00 0.00 42.92 38.74 3inj s ASP 282 CO 0.14 -1.91 1.62 -0.03 0.13 0.00 0.00 175.17 175.13 3inj h MET 283 N 14.21 -0.62 -0.99 4.34 1.85 -1.95 -0.60 114.93 131.17 3inj h MET 283 Ca -0.35 0.04 0.05 0.00 -0.61 0.00 0.00 59.70 58.83 3inj h MET 283 Cb 1.20 0.14 -0.06 0.00 0.43 0.00 0.00 31.60 33.31 3inj h MET 283 CO 1.02 -0.41 0.64 -0.44 -0.40 0.00 0.00 176.91 177.32 3inj h ASP 284 N -0.64 1.04 -0.10 1.39 3.32 -2.00 -0.18 116.42 119.25 3inj h ASP 284 Ca -0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 3inj h ASP 284 Cb 0.61 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3inj h ASP 284 CO -0.10 0.68 -0.29 -0.25 -1.72 0.00 0.00 179.24 177.56 3inj h TRP 285 N 1.18 0.49 -0.52 4.55 2.91 -1.94 -2.93 115.95 119.70 3inj h TRP 285 Ca 0.41 -0.19 -0.06 0.00 1.13 0.00 0.00 58.89 60.19 3inj h TRP 285 Cb 0.11 -0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 28.65 3inj h TRP 285 CO -0.00 0.90 0.09 0.00 -1.03 0.00 0.00 178.44 178.40 3inj h ALA 286 N 0.49 1.19 -0.47 2.65 0.00 -0.73 0.33 119.26 122.72 3inj h ALA 286 Ca -0.01 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 3inj h ALA 286 Cb 0.90 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3inj h ALA 286 CO 0.06 0.55 -0.05 0.28 0.00 0.00 0.00 179.25 180.09 3inj h VAL 287 N 0.78 1.27 -0.36 0.00 2.07 -1.12 -1.01 116.25 117.87 3inj h VAL 287 Ca 0.17 -1.14 -0.10 0.00 0.82 0.00 0.00 66.70 66.44 3inj h VAL 287 Cb 0.34 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3inj h VAL 287 CO 0.00 0.40 -0.17 -0.08 0.02 0.00 0.00 177.57 177.74 3inj h GLU 288 N 0.71 0.76 -0.15 1.57 4.57 -1.28 -2.41 114.58 118.35 3inj h GLU 288 Ca 0.13 -0.33 -0.11 0.00 -1.18 0.00 0.00 59.36 57.87 3inj h GLU 288 Cb 0.58 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 3inj h GLU 288 CO 0.03 0.94 -0.40 1.96 -1.18 0.00 0.00 179.01 180.37 3inj h GLN 289 N 0.55 0.32 -0.40 1.92 1.08 -0.92 -1.77 115.11 115.89 3inj h GLN 289 Ca 0.08 -0.15 -0.14 0.00 -1.45 0.00 0.00 58.65 56.99 3inj h GLN 289 Cb 0.71 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.13 3inj h GLN 289 CO 0.05 0.67 -0.30 0.00 -0.95 0.00 0.00 178.83 178.30 3inj h ALA 290 N 1.31 0.58 -0.22 3.87 0.00 -1.14 0.41 119.26 124.07 3inj h ALA 290 Ca 0.03 -0.42 0.03 0.00 0.00 0.00 0.00 54.91 54.54 3inj h ALA 290 Cb 0.82 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3inj h ALA 290 CO 0.07 0.62 0.06 1.25 0.00 0.00 0.00 179.25 181.25 3inj h HIS 291 N 0.73 0.11 -0.28 0.00 -0.00 -1.34 -2.67 115.15 111.70 3inj h HIS 291 Ca 0.08 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.46 3inj h HIS 291 Cb 0.89 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.27 3inj h HIS 291 CO 0.06 0.05 0.18 0.35 -0.00 0.00 0.00 177.93 178.57 3inj h PHE 292 N 0.16 0.36 -0.48 5.26 3.04 -1.12 -0.66 116.94 123.50 3inj h PHE 292 Ca 0.10 0.00 0.12 0.00 3.98 0.00 0.00 57.97 62.17 3inj h PHE 292 Cb 0.08 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.44 3inj h PHE 292 CO -0.13 0.25 0.34 0.00 -2.02 0.00 0.00 178.31 176.75 3inj h ALA 293 N 1.08 2.32 0.00 2.41 0.00 0.05 -2.53 119.26 122.58 3inj h ALA 293 Ca 0.10 -0.01 -0.46 0.00 0.00 0.00 0.00 54.91 54.54 3inj h ALA 293 Cb -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 3inj h ALA 293 CO -0.02 -0.45 -2.54 -0.11 0.00 0.00 0.00 179.25 176.13 3inj n LEU 294 N -4.42 2.07 0.07 0.00 -0.00 -1.03 -0.79 117.00 112.90 3inj n LEU 294 Ca 0.08 0.29 0.13 0.00 -0.00 0.00 0.00 56.01 56.51 3inj n LEU 294 Cb 0.49 -0.83 0.31 0.00 -0.00 0.00 0.00 43.42 43.39 3inj n LEU 294 CO 0.36 0.62 0.63 0.49 -0.00 0.00 0.00 177.39 179.48 3inj n PHE 295 N -4.15 0.59 -1.56 1.96 3.01 -0.27 -4.16 117.46 112.87 3inj n PHE 295 Ca -0.54 0.17 -0.45 0.00 1.01 0.00 0.00 57.45 57.64 3inj n PHE 295 Cb 0.90 -0.71 -0.02 0.00 -0.01 0.00 0.00 39.48 39.64 3inj n PHE 295 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3inj n PHE 296 N -2.05 1.04 -3.70 1.38 -0.00 -0.96 -2.04 117.46 111.13 3inj n PHE 296 Ca 0.05 0.74 -0.23 0.00 -0.00 0.00 0.00 57.45 58.00 3inj n PHE 296 Cb 0.42 -2.21 0.04 0.00 -0.00 0.00 0.00 39.48 37.73 3inj n PHE 296 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3inj n ASN 297 N 1.42 -2.76 -1.42 -2.13 5.15 -1.26 -1.22 115.26 113.03 3inj n ASN 297 Ca 0.11 -0.75 -0.18 0.00 -0.60 0.00 0.00 54.58 53.16 3inj n ASN 297 Cb 0.30 -4.28 -0.08 0.00 -0.53 0.00 0.00 39.78 35.19 3inj n ASN 297 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3inj n GLN 298 N -4.44 -1.50 -0.37 1.20 3.00 -0.93 -0.82 117.38 113.52 3inj n GLN 298 Ca -0.18 1.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 3inj n GLN 298 Cb 0.63 -5.50 0.00 0.00 0.00 0.00 0.00 30.24 25.37 3inj n GLN 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3inj n GLY 299 N -0.24 1.08 2.51 1.08 0.00 -0.36 -3.41 105.19 105.85 3inj n GLY 299 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 3inj n GLY 299 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3inj n GLN 300 N -2.00 4.22 -4.33 1.61 6.02 -0.00 -3.29 117.38 119.61 3inj n GLN 300 Ca 0.00 -3.19 -0.25 0.00 -0.01 0.00 0.00 57.00 53.54 3inj n GLN 300 Cb 0.00 -2.73 -0.17 0.00 1.02 0.00 0.00 30.24 28.36 3inj n GLN 300 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3inj n ALA 304 N 0.58 1.26 -1.47 0.00 0.00 -0.65 -4.77 120.51 115.45 3inj n ALA 304 Ca 0.24 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.64 3inj n ALA 304 Cb 1.03 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.18 3inj n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3inj n GLY 305 N 1.45 3.20 0.47 0.00 0.00 0.03 -3.39 105.19 106.95 3inj n GLY 305 Ca 0.08 -1.38 0.09 0.00 0.00 0.00 0.00 46.02 44.81 3inj n GLY 305 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3inj n SER 306 N 7.32 1.38 -3.73 1.61 3.41 -0.92 -4.36 113.62 118.33 3inj n SER 306 Ca 0.50 -1.74 -0.30 0.00 -0.26 0.00 0.00 58.87 57.07 3inj n SER 306 Cb 0.40 -0.11 -0.15 0.00 -0.26 0.00 0.00 64.21 64.09 3inj n SER 306 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3inj s ARG 307 N -1.77 0.79 -0.51 4.33 0.52 -1.04 -4.14 118.95 117.12 3inj s ARG 307 Ca 0.28 -1.20 -0.20 0.00 -0.52 0.00 0.00 55.73 54.09 3inj s ARG 307 Cb 0.15 -2.04 0.05 0.00 0.52 0.00 0.00 34.95 33.63 3inj s ARG 307 CO 0.22 -1.01 0.67 0.99 0.02 0.00 0.00 175.30 176.19 3inj s THR 308 N 1.45 4.80 -0.28 0.02 2.01 0.16 -0.66 115.64 123.14 3inj s THR 308 Ca 0.11 -0.35 -0.16 0.00 0.31 0.00 0.00 61.69 61.59 3inj s THR 308 Cb -0.18 -4.33 -0.03 0.00 0.01 0.00 0.00 72.50 67.97 3inj s THR 308 CO -0.22 -0.84 0.44 -0.36 -0.69 0.00 0.00 174.62 172.95 3inj s PHE 309 N 2.84 3.25 -0.14 4.92 0.40 0.26 0.60 117.98 130.11 3inj s PHE 309 Ca 0.18 0.46 0.01 0.00 -0.60 0.00 0.00 56.93 56.98 3inj s PHE 309 Cb -0.18 -2.67 0.02 0.00 0.51 0.00 0.00 43.02 40.70 3inj s PHE 309 CO 0.13 -0.29 -0.16 0.08 0.70 0.00 0.00 175.22 175.69 3inj s VAL 310 N 2.20 1.65 0.35 -0.44 1.01 0.43 0.30 120.40 125.89 3inj s VAL 310 Ca 0.18 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.17 3inj s VAL 310 Cb -0.16 -1.52 -0.12 0.00 0.00 0.00 0.00 36.38 34.59 3inj s VAL 310 CO 0.10 0.47 1.38 1.67 0.00 0.00 0.00 175.10 178.72 3inj n GLN 311 N 4.50 2.35 -0.05 2.72 0.00 -0.69 -2.52 117.38 123.69 3inj n GLN 311 Ca -0.18 0.83 0.12 0.00 -0.00 0.00 0.00 57.00 57.76 3inj n GLN 311 Cb 0.51 -2.47 0.52 0.00 0.00 0.00 0.00 30.24 28.79 3inj n GLN 311 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 3inj h GLU 312 N 2.90 0.36 0.00 3.69 4.11 -1.21 -1.78 114.58 122.65 3inj h GLU 312 Ca -0.48 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 58.90 3inj h GLU 312 Cb 1.26 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 3inj h GLU 312 CO 0.65 0.24 -0.16 -0.44 0.07 0.00 0.00 179.01 179.36 3inj h ASP 313 N 0.37 0.00 -0.01 3.06 3.32 -1.89 -2.68 116.42 118.59 3inj h ASP 313 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3inj h ASP 313 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3inj h ASP 313 CO -0.06 0.16 -0.13 2.30 -1.72 0.00 0.00 179.24 179.79 3inj n ILE 314 N -3.71 0.00 -0.11 0.35 -5.35 -0.74 -4.79 119.36 105.00 3inj n ILE 314 Ca -0.02 -0.44 -0.07 0.00 -0.27 0.00 0.00 62.75 61.96 3inj n ILE 314 Cb 0.28 1.20 -0.00 0.00 -1.74 0.00 0.00 39.64 39.37 3inj n ILE 314 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 3inj h TYR 315 N 1.87 -0.71 -0.48 4.28 5.03 -1.01 -1.69 116.97 124.27 3inj h TYR 315 Ca 0.00 0.05 -0.01 0.00 2.58 0.00 0.00 58.73 61.35 3inj h TYR 315 Cb 0.46 0.37 -0.02 0.00 1.55 0.00 0.00 36.73 39.09 3inj h TYR 315 CO 0.00 -0.34 0.26 -0.44 -1.32 0.00 0.00 178.16 176.32 3inj h ASP 316 N -0.20 0.60 -0.43 -2.11 3.32 -1.87 -1.58 116.42 114.15 3inj h ASP 316 Ca 0.18 -0.09 -0.11 0.00 0.02 0.00 0.00 57.03 57.03 3inj h ASP 316 Cb 0.49 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3inj h ASP 316 CO -0.51 0.52 -0.14 -0.08 -1.72 0.00 0.00 179.24 177.31 3inj h GLU 317 N 0.63 0.91 -0.69 3.56 4.81 -1.84 -2.43 114.58 119.53 3inj h GLU 317 Ca 0.17 -0.34 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 3inj h GLU 317 Cb 0.06 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 3inj h GLU 317 CO -0.03 0.98 0.29 0.35 -0.73 0.00 0.00 179.01 179.88 3inj h PHE 318 N 0.80 1.04 -0.24 0.92 3.57 -0.99 -2.38 116.94 119.67 3inj h PHE 318 Ca 0.12 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 3inj h PHE 318 Cb 0.67 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 3inj h PHE 318 CO 0.04 0.80 0.03 0.28 -2.23 0.00 0.00 178.31 177.23 3inj h VAL 319 N 0.98 1.23 -0.69 1.41 2.07 -1.07 -0.42 116.25 119.76 3inj h VAL 319 Ca 0.23 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 3inj h VAL 319 Cb 0.19 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 3inj h VAL 319 CO -0.02 0.25 0.37 1.05 0.02 0.00 0.00 177.57 179.23 3inj h GLU 320 N 0.19 0.97 -0.49 1.57 -0.00 -1.38 0.73 114.58 116.17 3inj h GLU 320 Ca 0.07 -0.12 -0.08 0.00 -0.00 0.00 0.00 59.36 59.24 3inj h GLU 320 Cb 0.34 -0.19 -0.02 0.00 -0.00 0.00 0.00 28.75 28.88 3inj h GLU 320 CO 0.01 0.74 -0.00 0.00 -0.00 0.00 0.00 179.01 179.75 3inj h ARG 321 N 0.95 0.81 -0.25 1.06 3.08 -1.34 -2.14 114.38 116.54 3inj h ARG 321 Ca 0.24 -0.22 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 3inj h ARG 321 Cb 0.06 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3inj h ARG 321 CO -0.04 0.82 -0.22 0.77 -1.07 0.00 0.00 179.97 180.23 3inj h SER 322 N 0.76 0.62 -0.58 7.04 0.02 -0.62 -1.92 113.55 118.87 3inj h SER 322 Ca 0.15 -0.46 0.03 0.00 -0.84 0.00 0.00 61.79 60.67 3inj h SER 322 Cb 0.46 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 3inj h SER 322 CO 0.02 0.95 0.35 0.58 -1.14 0.00 0.00 176.83 177.59 3inj h VAL 323 N 0.30 1.04 -0.55 2.27 2.07 -0.76 0.10 116.25 120.73 3inj h VAL 323 Ca 0.04 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 3inj h VAL 323 Cb 0.77 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3inj h VAL 323 CO 0.06 0.12 0.24 0.00 0.02 0.00 0.00 177.57 178.01 3inj h ALA 324 N 1.27 0.71 -0.60 1.67 0.00 -1.33 0.25 119.26 121.22 3inj h ALA 324 Ca 0.24 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3inj h ALA 324 Cb 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3inj h ALA 324 CO -0.12 0.30 0.13 -0.09 0.00 0.00 0.00 179.25 179.47 3inj h ARG 325 N 0.74 0.95 -0.11 0.00 9.65 -0.93 -2.39 114.38 122.29 3inj h ARG 325 Ca 0.19 -0.22 -0.23 0.00 -1.10 0.00 0.00 59.98 58.62 3inj h ARG 325 Cb 0.16 -0.13 0.01 0.00 -1.39 0.00 0.00 29.97 28.62 3inj h ARG 325 CO -0.02 0.86 -0.83 0.00 2.80 0.00 0.00 179.97 182.78 3inj h ALA 326 N 1.23 0.32 0.00 2.80 0.00 -0.46 -2.75 119.26 120.40 3inj h ALA 326 Ca 0.19 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3inj h ALA 326 Cb 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3inj h ALA 326 CO 0.00 0.70 0.00 0.87 0.00 0.00 0.00 179.25 180.83 3inj h LYS 327 N 0.47 0.00 -0.02 0.00 1.57 -0.94 -2.86 116.57 114.80 3inj h LYS 327 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3inj h LYS 327 Cb 1.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.76 3inj h LYS 327 CO 0.16 0.00 -0.20 0.43 -0.57 0.00 0.00 179.45 179.27 3inj n SER 328 N -2.76 1.86 -4.66 0.86 7.64 -0.90 -4.90 113.62 110.75 3inj n SER 328 Ca 0.01 -1.45 -0.43 0.00 1.01 0.00 0.00 58.87 58.01 3inj n SER 328 Cb 0.26 0.17 -0.02 0.00 -1.01 0.00 0.00 64.21 63.60 3inj n SER 328 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 3inj s ARG 329 N -2.27 4.22 -0.28 1.43 3.52 -1.06 -4.99 118.95 119.53 3inj s ARG 329 Ca 0.27 1.66 -0.28 0.00 -0.13 0.00 0.00 55.73 57.24 3inj s ARG 329 Cb 0.19 -3.77 0.01 0.00 -1.56 0.00 0.00 34.95 29.83 3inj s ARG 329 CO 0.44 -0.72 1.03 0.08 -0.81 0.00 0.00 175.30 175.32 3inj s VAL 330 N 3.52 4.61 -0.15 7.11 1.01 -1.26 -4.93 120.40 130.32 3inj s VAL 330 Ca 0.55 1.80 -0.07 0.00 0.00 0.00 0.00 61.98 64.27 3inj s VAL 330 Cb -0.22 -4.34 -0.04 0.00 0.00 0.00 0.00 36.38 31.78 3inj s VAL 330 CO 0.15 -0.33 0.08 -0.69 0.00 0.00 0.00 175.10 174.31 3inj s VAL 331 N 3.39 5.01 -2.78 2.92 1.01 -1.26 -0.26 120.40 128.43 3inj s VAL 331 Ca 0.43 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.45 3inj s VAL 331 Cb -0.14 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.04 3inj s VAL 331 CO 0.11 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.36 3inj n GLY 332 N 2.75 -0.79 3.61 4.51 0.00 -0.91 -4.97 105.19 109.39 3inj n GLY 332 Ca -0.18 -0.94 -0.52 0.00 0.00 0.00 0.00 46.02 44.39 3inj n GLY 332 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3inj n ASN 333 N 0.56 2.70 0.16 1.61 2.85 -1.26 -4.46 115.26 117.42 3inj n ASN 333 Ca 0.00 0.80 0.10 0.00 -0.11 0.00 0.00 54.58 55.37 3inj n ASN 333 Cb 0.00 -1.27 0.55 0.00 1.24 0.00 0.00 39.78 40.29 3inj n ASN 333 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3inj n PRO 334 N 6.86 0.13 0.01 1.20 -0.04 -1.26 -1.01 135.00 140.89 3inj n PRO 334 Ca 0.30 0.63 0.12 0.00 -0.04 0.00 0.00 63.50 64.51 3inj n PRO 334 Cb 0.23 -1.97 0.25 0.00 -0.04 0.00 0.00 33.50 31.97 3inj n PRO 334 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3inj n PHE 335 N -2.21 0.12 -2.67 0.54 3.01 -1.26 -0.23 117.46 114.76 3inj n PHE 335 Ca -0.01 0.04 -0.43 0.00 1.01 0.00 0.00 57.45 58.06 3inj n PHE 335 Cb 0.07 -0.36 -0.02 0.00 -0.01 0.00 0.00 39.48 39.16 3inj n PHE 335 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3inj s ASP 336 N -3.28 7.17 0.55 4.37 -1.08 -0.18 -4.88 116.67 119.34 3inj s ASP 336 Ca 0.10 1.45 0.37 0.00 -0.52 0.00 0.00 52.55 53.95 3inj s ASP 336 Cb 0.17 -2.55 2.01 0.00 -1.46 0.00 0.00 42.92 41.09 3inj s ASP 336 CO 0.70 -0.56 2.13 0.77 0.52 0.00 0.00 175.17 178.72 3inj h SER 337 N 7.28 0.00 1.31 -0.34 4.64 -1.87 -0.79 113.55 123.78 3inj h SER 337 Ca -0.25 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.00 3inj h SER 337 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 3inj h SER 337 CO 0.92 0.00 -0.36 0.50 -0.87 0.00 0.00 176.83 177.02 3inj h LYS 338 N 0.00 0.00 -6.47 4.77 3.64 -1.93 -3.47 116.57 113.12 3inj h LYS 338 Ca 0.00 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.84 3inj h LYS 338 Cb 0.01 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3inj h LYS 338 CO 0.00 0.36 0.69 0.99 -2.27 0.00 0.00 179.45 179.22 3inj s THR 339 N -3.25 3.70 -0.14 1.00 2.01 -0.30 -4.79 115.64 113.88 3inj s THR 339 Ca 0.03 1.19 0.04 0.00 0.31 0.00 0.00 61.69 63.26 3inj s THR 339 Cb 0.08 -3.76 -0.23 0.00 0.01 0.00 0.00 72.50 68.60 3inj s THR 339 CO 0.70 0.07 0.28 -0.62 -0.69 0.00 0.00 174.62 174.36 3inj n GLU 340 N 4.32 0.69 -3.90 4.92 1.02 0.64 -4.87 120.64 123.46 3inj n GLU 340 Ca 0.11 0.21 -0.26 0.00 -0.02 0.00 0.00 57.16 57.19 3inj n GLU 340 Cb 0.44 -1.67 -0.17 0.00 -0.02 0.00 0.00 31.44 30.03 3inj n GLU 340 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 3inj s GLN 341 N -2.55 1.40 0.00 3.49 0.74 -0.17 -4.80 119.66 117.78 3inj s GLN 341 Ca -0.18 -0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.02 3inj s GLN 341 Cb 0.07 -1.50 0.00 0.00 1.10 0.00 0.00 33.01 32.69 3inj s GLN 341 CO 0.76 -0.27 0.00 0.41 -0.55 0.00 0.00 175.29 175.64 3inj n GLY 342 N 4.95 -0.22 3.91 2.59 0.00 -1.26 -2.14 105.19 113.03 3inj n GLY 342 Ca -0.12 -1.73 -0.27 0.00 0.00 0.00 0.00 46.02 43.90 3inj n GLY 342 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3inj s PRO 343 N 0.09 2.78 0.73 1.61 0.04 -1.25 -4.78 135.00 134.21 3inj s PRO 343 Ca 0.00 0.06 -0.13 0.00 0.04 0.00 0.00 61.00 60.98 3inj s PRO 343 Cb 0.00 -2.19 0.04 0.00 0.04 0.00 0.00 34.50 32.38 3inj s PRO 343 CO 0.00 -0.87 1.12 -0.65 0.04 0.00 0.00 177.00 176.63 3inj s GLN 344 N -5.12 2.37 0.31 4.56 -1.52 0.27 -4.74 119.66 115.79 3inj s GLN 344 Ca 0.56 1.36 0.03 0.00 -1.95 0.00 0.00 55.36 55.36 3inj s GLN 344 Cb -0.11 -1.90 0.52 0.00 -0.22 0.00 0.00 33.01 31.31 3inj s GLN 344 CO 0.47 -1.58 1.83 -0.24 -0.25 0.00 0.00 175.29 175.52 3inj h VAL 345 N -0.61 1.22 -3.17 1.09 3.04 -1.87 -3.42 116.25 112.53 3inj h VAL 345 Ca -0.45 -0.89 -0.11 0.00 -1.01 0.00 0.00 66.70 64.23 3inj h VAL 345 Cb 1.25 0.98 -0.02 0.00 -2.01 0.00 0.00 31.29 31.49 3inj h VAL 345 CO 0.51 0.30 0.07 -0.90 -1.01 0.00 0.00 177.57 176.55 3inj n ASP 346 N -4.25 -1.54 0.18 3.17 5.68 -1.26 -4.59 116.55 113.94 3inj n ASP 346 Ca 0.01 -2.41 0.04 0.00 -0.50 0.00 0.00 54.79 51.94 3inj n ASP 346 Cb 0.28 2.66 0.33 0.00 -1.14 0.00 0.00 41.12 43.25 3inj n ASP 346 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3inj h GLU 347 N 0.00 0.00 -0.24 0.11 4.81 -1.98 -0.51 114.58 116.77 3inj h GLU 347 Ca -0.25 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.93 3inj h GLU 347 Cb 0.99 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 3inj h GLU 347 CO 0.33 0.42 -0.04 1.15 -0.73 0.00 0.00 179.01 180.13 3inj h THR 348 N 0.00 1.28 -0.28 0.32 2.02 -1.99 -0.67 112.91 113.58 3inj h THR 348 Ca -0.00 -1.01 -0.07 0.00 0.77 0.00 0.00 66.41 66.09 3inj h THR 348 Cb 0.86 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 3inj h THR 348 CO 0.05 0.32 -0.11 1.56 0.37 0.00 0.00 175.52 177.71 3inj h GLN 349 N 0.21 0.56 -0.50 6.66 1.08 -1.95 -2.13 115.11 119.03 3inj h GLN 349 Ca 0.06 -0.24 0.08 0.00 -1.45 0.00 0.00 58.65 57.11 3inj h GLN 349 Cb 0.49 -0.02 -0.10 0.00 -0.05 0.00 0.00 27.48 27.79 3inj h GLN 349 CO 0.02 0.80 -0.41 0.35 -0.95 0.00 0.00 178.83 178.64 3inj h PHE 350 N 0.31 -1.18 -0.29 2.96 3.57 -1.01 -0.81 116.94 120.49 3inj h PHE 350 Ca 0.06 0.07 -0.13 0.00 3.53 0.00 0.00 57.97 61.51 3inj h PHE 350 Cb 0.61 0.59 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 3inj h PHE 350 CO 0.06 -0.42 -0.34 0.87 -2.23 0.00 0.00 178.31 176.25 3inj h LYS 351 N -0.25 0.65 -0.52 1.11 1.57 -1.08 -2.63 116.57 115.41 3inj h LYS 351 Ca 0.17 -0.30 -0.12 0.00 -1.87 0.00 0.00 60.65 58.53 3inj h LYS 351 Cb 0.57 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 3inj h LYS 351 CO -0.63 0.90 -0.13 -0.22 -0.57 0.00 0.00 179.45 178.79 3inj h LYS 352 N 0.55 1.00 -0.19 3.15 3.64 -1.05 -1.36 116.57 122.30 3inj h LYS 352 Ca 0.06 -0.38 -0.02 0.00 -1.27 0.00 0.00 60.65 59.04 3inj h LYS 352 Cb 0.84 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 3inj h LYS 352 CO 0.07 1.06 0.04 0.82 -2.27 0.00 0.00 179.45 179.17 3inj h ILE 353 N 0.88 1.21 -0.81 2.00 2.04 -1.09 -1.66 117.51 120.09 3inj h ILE 353 Ca 0.13 -0.67 0.09 0.00 1.00 0.00 0.00 64.86 65.41 3inj h ILE 353 Cb 0.69 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 3inj h ILE 353 CO 0.05 0.21 0.53 -0.07 0.00 0.00 0.00 178.15 178.87 3inj h LEU 354 N 0.13 0.70 0.04 1.44 3.38 -1.38 -1.15 115.31 118.47 3inj h LEU 354 Ca 0.06 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3inj h LEU 354 Cb 0.28 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3inj h LEU 354 CO 0.00 0.42 -0.08 1.23 0.09 0.00 0.00 178.44 180.10 3inj h GLY 355 N 0.78 -0.12 0.91 0.83 0.00 -0.86 -1.63 103.07 102.97 3inj h GLY 355 Ca 0.37 0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.82 3inj h GLY 355 CO -0.14 -0.08 0.62 -0.97 0.00 0.00 0.00 176.54 175.97 3inj h TYR 356 N -0.16 1.17 -0.35 5.60 -1.99 -0.36 -0.99 116.97 119.90 3inj h TYR 356 Ca 0.02 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.80 3inj h TYR 356 Cb 0.17 -0.39 -0.03 0.00 2.00 0.00 0.00 36.73 38.47 3inj h TYR 356 CO -0.12 0.69 0.15 0.82 -0.00 0.00 0.00 178.16 179.71 3inj h ILE 357 N 1.23 0.95 -0.55 -2.88 2.04 -1.08 0.35 117.51 117.57 3inj h ILE 357 Ca 0.37 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 66.12 3inj h ILE 357 Cb -0.04 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 3inj h ILE 357 CO -0.11 0.06 0.34 -1.13 0.00 0.00 0.00 178.15 177.31 3inj h ASN 358 N 0.32 0.65 -0.38 1.72 -0.73 -0.64 -0.30 115.58 116.23 3inj h ASN 358 Ca 0.15 -0.05 0.03 0.00 1.87 0.00 0.00 56.30 58.31 3inj h ASN 358 Cb 0.09 -0.16 -0.04 0.00 0.27 0.00 0.00 38.32 38.48 3inj h ASN 358 CO -0.12 0.50 0.17 0.74 -0.37 0.00 0.00 177.43 178.35 3inj h THR 359 N 0.74 0.95 -0.50 -3.57 2.02 -0.85 0.69 112.91 112.38 3inj h THR 359 Ca 0.20 -0.12 0.09 0.00 0.77 0.00 0.00 66.41 67.35 3inj h THR 359 Cb -0.04 0.56 -0.10 0.00 -1.74 0.00 0.00 68.15 66.83 3inj h THR 359 CO -0.04 0.06 -0.33 1.23 0.37 0.00 0.00 175.52 176.82 3inj h GLY 360 N 0.35 -0.17 1.00 2.16 0.00 0.56 0.71 103.07 107.68 3inj h GLY 360 Ca 0.17 0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.91 3inj h GLY 360 CO -0.14 -0.21 -0.14 0.50 0.00 0.00 0.00 176.54 176.56 3inj h LYS 361 N -0.20 -0.36 -0.43 4.80 1.57 -0.51 -2.64 116.57 118.79 3inj h LYS 361 Ca 0.20 0.02 0.04 0.00 -1.87 0.00 0.00 60.65 59.05 3inj h LYS 361 Cb 0.54 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3inj h LYS 361 CO -0.61 -0.24 0.29 1.96 -0.57 0.00 0.00 179.45 180.27 3inj h GLN 362 N -0.38 0.43 -0.20 3.15 4.20 -0.45 -2.02 115.11 119.84 3inj h GLN 362 Ca -0.04 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3inj h GLN 362 Cb 0.29 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.97 3inj h GLN 362 CO 0.06 0.28 0.00 0.39 -0.67 0.00 0.00 178.83 178.90 3inj n GLU 363 N -4.48 1.59 -0.64 1.46 1.02 0.20 -4.91 120.64 114.89 3inj n GLU 363 Ca 0.05 -0.91 0.00 0.00 -0.02 0.00 0.00 57.16 56.28 3inj n GLU 363 Cb 0.17 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 3inj n GLU 363 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3inj n GLY 364 N 0.99 0.63 3.78 0.62 0.00 -0.76 -5.01 105.19 105.44 3inj n GLY 364 Ca 0.12 -0.42 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 3inj n GLY 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3inj s ALA 365 N -2.00 2.57 -0.25 4.61 0.00 -1.01 -4.99 121.76 120.69 3inj s ALA 365 Ca 0.00 0.55 -0.21 0.00 0.00 0.00 0.00 51.96 52.30 3inj s ALA 365 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 3inj s ALA 365 CO 0.00 -1.09 0.66 0.21 0.00 0.00 0.00 175.76 175.54 3inj s LYS 366 N -3.98 4.13 -0.48 0.00 2.20 -0.60 -4.71 119.74 116.30 3inj s LYS 366 Ca 0.67 0.61 -0.27 0.00 -0.36 0.00 0.00 55.97 56.62 3inj s LYS 366 Cb -0.20 -3.65 0.03 0.00 -1.51 0.00 0.00 37.83 32.51 3inj s LYS 366 CO 0.38 -0.42 1.02 -1.17 -0.36 0.00 0.00 175.35 174.81 3inj s LEU 367 N 2.52 3.83 -0.13 5.43 2.96 -1.26 -0.76 118.68 131.28 3inj s LEU 367 Ca 0.28 0.22 0.09 0.00 -0.22 0.00 0.00 54.13 54.49 3inj s LEU 367 Cb -0.15 -3.30 -0.23 0.00 0.50 0.00 0.00 46.19 43.00 3inj s LEU 367 CO 0.08 -1.17 0.33 0.18 -1.32 0.00 0.00 176.35 174.46 3inj n LEU 368 N 7.53 1.20 -3.81 -0.68 4.77 -0.14 -5.00 117.00 120.87 3inj n LEU 368 Ca 0.08 0.19 -0.05 0.00 -0.03 0.00 0.00 56.01 56.20 3inj n LEU 368 Cb 0.49 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 3inj n LEU 368 CO 0.68 0.57 0.60 0.00 -1.33 0.00 0.00 177.39 177.90 3inj n GLY 370 N -0.48 2.56 0.00 0.00 0.00 -1.19 -2.74 105.19 103.34 3inj n GLY 370 Ca -0.05 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3inj n GLY 370 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inj n GLY 371 N 0.00 0.73 3.10 -0.02 0.00 -1.26 -4.98 105.19 102.76 3inj n GLY 371 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 3inj n GLY 371 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inj n GLY 372 N -1.49 2.33 3.77 -0.02 0.00 -1.26 -4.95 105.19 103.57 3inj n GLY 372 Ca 0.00 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 43.96 3inj n GLY 372 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3inj s ILE 373 N -2.88 2.71 -0.28 -0.61 1.01 -1.26 -1.29 121.20 118.59 3inj s ILE 373 Ca 0.29 0.70 0.22 0.00 0.00 0.00 0.00 60.65 61.86 3inj s ILE 373 Cb -0.00 -3.44 -0.18 0.00 0.01 0.00 0.00 42.46 38.84 3inj s ILE 373 CO 0.21 0.16 0.79 0.00 0.00 0.00 0.00 174.94 176.10 3inj n ALA 374 N 0.71 2.98 -2.98 9.38 0.00 0.93 -4.69 120.51 126.84 3inj n ALA 374 Ca 0.00 -0.42 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 3inj n ALA 374 Cb 0.42 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 18.93 3inj n ALA 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3inj s ALA 375 N -3.37 0.51 -1.37 0.00 0.00 -1.25 -4.98 121.76 111.29 3inj s ALA 375 Ca -0.02 -1.36 0.17 0.00 0.00 0.00 0.00 51.96 50.74 3inj s ALA 375 Cb 0.13 1.11 -0.04 0.00 0.00 0.00 0.00 23.12 24.32 3inj s ALA 375 CO 0.85 -0.81 0.84 -0.25 0.00 0.00 0.00 175.76 176.39 3inj n ASP 376 N -1.20 1.48 -4.03 0.00 8.00 -1.26 -4.89 116.55 114.66 3inj n ASP 376 Ca -0.00 -1.24 -0.11 0.00 0.71 0.00 0.00 54.79 54.15 3inj n ASP 376 Cb 0.62 0.58 -0.11 0.00 -0.02 0.00 0.00 41.12 42.19 3inj n ASP 376 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3inj s ARG 377 N -2.08 0.44 0.56 -1.24 6.06 -1.26 -5.09 118.95 116.34 3inj s ARG 377 Ca 0.12 -0.69 0.00 0.00 -2.50 0.00 0.00 55.73 52.66 3inj s ARG 377 Cb 0.13 -0.13 0.00 0.00 0.06 0.00 0.00 34.95 35.01 3inj s ARG 377 CO 0.47 0.01 0.00 0.41 -2.50 0.00 0.00 175.30 173.69 3inj n GLY 378 N 1.53 -2.02 2.79 8.12 0.00 -1.22 -4.58 105.19 109.82 3inj n GLY 378 Ca -0.23 -1.38 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 3inj n GLY 378 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3inj n TYR 379 N -1.36 3.48 -3.47 1.61 4.02 -0.89 -4.95 117.16 115.59 3inj n TYR 379 Ca 0.00 -3.45 -0.38 0.00 -0.01 0.00 0.00 57.90 54.07 3inj n TYR 379 Cb 0.11 -0.78 -0.08 0.00 -0.02 0.00 0.00 39.34 38.57 3inj n TYR 379 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3inj s PHE 380 N -3.60 3.37 -0.03 -0.72 0.40 -1.26 0.96 117.98 117.10 3inj s PHE 380 Ca 0.44 0.53 0.07 0.00 -0.60 0.00 0.00 56.93 57.37 3inj s PHE 380 Cb 0.22 -2.45 -0.02 0.00 0.51 0.00 0.00 43.02 41.29 3inj s PHE 380 CO -0.11 0.04 -0.25 0.42 0.70 0.00 0.00 175.22 176.02 3inj s ILE 381 N 1.14 2.03 0.35 0.64 1.01 -1.26 -0.05 121.20 125.07 3inj s ILE 381 Ca 0.16 -1.09 -0.28 0.00 0.00 0.00 0.00 60.65 59.44 3inj s ILE 381 Cb -0.14 -1.70 -0.10 0.00 0.01 0.00 0.00 42.46 40.53 3inj s ILE 381 CO 0.07 0.57 1.36 -1.10 0.00 0.00 0.00 174.94 175.84 3inj s GLN 382 N -0.45 4.25 0.06 2.79 -0.21 -0.41 -4.75 119.66 120.94 3inj s GLN 382 Ca 0.05 2.32 -0.31 0.00 0.02 0.00 0.00 55.36 57.44 3inj s GLN 382 Cb -0.11 -3.01 -0.10 0.00 1.00 0.00 0.00 33.01 30.79 3inj s GLN 382 CO 0.01 -0.32 1.91 -2.30 -2.12 0.00 0.00 175.29 172.47 3inj n PRO 383 N 0.63 2.78 -4.90 2.91 -0.02 -1.26 -4.26 135.00 130.89 3inj n PRO 383 Ca 0.01 1.02 -0.27 0.00 -2.02 0.00 0.00 63.50 62.23 3inj n PRO 383 Cb 0.41 -2.94 -0.15 0.00 -0.02 0.00 0.00 33.50 30.80 3inj n PRO 383 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3inj s THR 384 N 3.74 1.69 -0.05 3.45 2.01 0.31 -3.17 115.64 123.61 3inj s THR 384 Ca 0.87 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 61.84 3inj s THR 384 Cb -0.48 -1.43 0.02 0.00 0.01 0.00 0.00 72.50 70.63 3inj s THR 384 CO 0.41 0.38 -0.02 -0.69 -0.69 0.00 0.00 174.62 174.00 3inj s VAL 385 N -0.61 0.45 -0.20 3.82 1.01 -1.11 -0.65 120.40 123.11 3inj s VAL 385 Ca 0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 3inj s VAL 385 Cb -0.08 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 3inj s VAL 385 CO 0.00 0.23 0.03 -0.36 0.00 0.00 0.00 175.10 175.00 3inj s PHE 386 N 1.31 3.10 0.36 5.22 0.40 0.95 -0.97 117.98 128.35 3inj s PHE 386 Ca -0.05 -0.29 0.07 0.00 -0.60 0.00 0.00 56.93 56.06 3inj s PHE 386 Cb -0.13 -2.10 -0.02 0.00 0.51 0.00 0.00 43.02 41.28 3inj s PHE 386 CO -0.02 -0.14 0.35 0.20 0.70 0.00 0.00 175.22 176.31 3inj s GLY 387 N 0.88 1.88 -1.47 4.36 0.00 0.06 -0.87 107.32 112.17 3inj s GLY 387 Ca 0.02 -1.71 -0.11 0.00 0.00 0.00 0.00 44.72 42.91 3inj s GLY 387 CO 0.02 -1.60 1.02 1.22 0.00 0.00 0.00 173.10 173.77 3inj n ASP 388 N -1.47 -5.46 -4.76 1.64 8.00 -1.08 -1.56 116.55 111.86 3inj n ASP 388 Ca 0.01 -0.65 -0.39 0.00 0.71 0.00 0.00 54.79 54.46 3inj n ASP 388 Cb 0.60 -4.34 -0.06 0.00 -0.02 0.00 0.00 41.12 37.31 3inj n ASP 388 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3inj s VAL 389 N -3.28 3.93 0.04 2.53 1.01 -0.52 -4.68 120.40 119.43 3inj s VAL 389 Ca 0.61 1.87 0.05 0.00 0.00 0.00 0.00 61.98 64.51 3inj s VAL 389 Cb -0.29 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 3inj s VAL 389 CO 0.75 0.39 -0.09 -1.10 0.00 0.00 0.00 175.10 175.06 3inj s GLN 390 N -1.44 2.39 0.53 2.72 -1.52 -1.26 -4.51 119.66 116.56 3inj s GLN 390 Ca 0.44 -0.84 0.37 0.00 -1.95 0.00 0.00 55.36 53.38 3inj s GLN 390 Cb -0.26 -2.42 1.54 0.00 -0.22 0.00 0.00 33.01 31.65 3inj s GLN 390 CO 0.33 0.57 1.77 -0.44 -0.25 0.00 0.00 175.29 177.26 3inj h ASP 391 N 4.24 0.04 0.45 5.90 3.32 -1.97 -1.24 116.42 127.17 3inj h ASP 391 Ca -0.48 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3inj h ASP 391 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 3inj h ASP 391 CO 0.53 0.00 -0.48 0.61 -1.72 0.00 0.00 179.24 178.18 3inj n GLY 392 N -1.76 -1.15 3.77 2.75 0.00 -1.26 -4.54 105.19 103.00 3inj n GLY 392 Ca 0.28 -0.36 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 3inj n GLY 392 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3inj s MET 393 N -2.93 3.49 0.17 1.61 -1.94 -0.47 -4.95 119.30 114.28 3inj s MET 393 Ca 0.13 1.64 -0.15 0.00 -1.71 0.00 0.00 55.69 55.59 3inj s MET 393 Cb 0.18 -2.11 0.11 0.00 2.01 0.00 0.00 34.83 35.01 3inj s MET 393 CO 0.68 -0.74 1.73 1.15 -0.01 0.00 0.00 175.02 177.83 3inj h THR 394 N 1.40 0.82 0.00 2.05 2.02 -1.90 -1.29 112.91 116.01 3inj h THR 394 Ca -0.50 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 66.60 3inj h THR 394 Cb 1.26 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3inj h THR 394 CO 0.58 0.04 0.00 0.16 0.37 0.00 0.00 175.52 176.67 3inj h ILE 395 N 0.24 0.00 0.00 3.11 3.07 -1.89 0.91 117.51 122.94 3inj h ILE 395 Ca 0.19 -0.16 0.00 0.00 1.55 0.00 0.00 64.86 66.44 3inj h ILE 395 Cb 0.22 0.93 0.00 0.00 -0.27 0.00 0.00 36.82 37.70 3inj h ILE 395 CO -0.24 0.00 -0.32 0.00 -1.05 0.00 0.00 178.15 176.55 3inj n ALA 396 N -1.92 2.65 -0.03 0.16 0.00 -0.50 -4.43 120.51 116.44 3inj n ALA 396 Ca -0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 3inj n ALA 396 Cb 0.14 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 3inj n ALA 396 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3inj n LYS 397 N -2.11 0.56 -3.62 0.00 5.02 -0.24 -4.98 118.16 112.79 3inj n LYS 397 Ca 0.05 0.03 -0.37 0.00 -2.02 0.00 0.00 58.31 56.00 3inj n LYS 397 Cb 0.42 -1.13 -0.06 0.00 -0.02 0.00 0.00 35.03 34.25 3inj n LYS 397 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3inj s GLU 398 N -2.12 3.75 -0.08 1.97 2.02 0.15 -4.89 118.70 119.50 3inj s GLU 398 Ca -0.08 0.21 -0.30 0.00 0.02 0.00 0.00 54.97 54.82 3inj s GLU 398 Cb 0.02 -3.16 -0.05 0.00 0.10 0.00 0.00 34.13 31.04 3inj s GLU 398 CO 0.15 0.68 1.65 -2.00 0.02 0.00 0.00 175.26 175.77 3inj s GLU 399 N -1.29 4.10 -0.09 1.61 2.12 -1.26 -4.80 118.70 119.09 3inj s GLU 399 Ca 0.24 2.10 0.06 0.00 0.36 0.00 0.00 54.97 57.73 3inj s GLU 399 Cb -0.15 -4.00 -0.24 0.00 0.26 0.00 0.00 34.13 30.00 3inj s GLU 399 CO 0.13 -0.94 0.49 -0.89 -0.54 0.00 0.00 175.26 173.51 3inj n ILE 400 N 5.66 1.65 -3.74 -3.70 5.41 -1.26 -5.00 119.36 118.39 3inj n ILE 400 Ca 0.18 -0.74 -0.27 0.00 1.00 0.00 0.00 62.75 62.92 3inj n ILE 400 Cb 0.43 -1.26 0.06 0.00 -0.71 0.00 0.00 39.64 38.16 3inj n ILE 400 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 3inj n PHE 401 N -3.19 -2.64 -4.01 1.39 7.35 -1.26 -4.72 117.46 110.38 3inj n PHE 401 Ca -0.24 0.97 -0.14 0.00 -0.76 0.00 0.00 57.45 57.28 3inj n PHE 401 Cb 1.06 -4.59 -0.02 0.00 0.35 0.00 0.00 39.48 36.28 3inj n PHE 401 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 3inj s GLY 402 N -3.31 1.25 -0.51 7.13 0.00 -1.21 -4.21 107.32 106.45 3inj s GLY 402 Ca 0.62 -1.35 -0.07 0.00 0.00 0.00 0.00 44.72 43.93 3inj s GLY 402 CO 0.77 -0.82 3.20 -1.05 0.00 0.00 0.00 173.10 175.21 3inj n PRO 403 N -0.58 2.39 -3.99 2.90 -0.02 -1.22 -4.47 135.00 130.01 3inj n PRO 403 Ca -0.02 -1.31 -0.30 0.00 -2.02 0.00 0.00 63.50 59.85 3inj n PRO 403 Cb 0.61 -2.23 -0.16 0.00 -0.02 0.00 0.00 33.50 31.70 3inj n PRO 403 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3inj s VAL 404 N 1.57 1.49 -0.15 -1.45 1.01 -1.26 -0.53 120.40 121.08 3inj s VAL 404 Ca 0.63 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 3inj s VAL 404 Cb 0.25 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 3inj s VAL 404 CO -0.02 0.35 0.02 -0.32 0.00 0.00 0.00 175.10 175.12 3inj s MET 405 N 1.50 3.63 -0.21 2.72 1.75 0.18 -4.98 119.30 123.89 3inj s MET 405 Ca 0.03 -0.41 -0.05 0.00 -1.25 0.00 0.00 55.69 54.01 3inj s MET 405 Cb -0.14 -3.01 -0.02 0.00 2.84 0.00 0.00 34.83 34.50 3inj s MET 405 CO -0.10 0.38 -0.01 -0.65 -0.65 0.00 0.00 175.02 173.99 3inj s GLN 406 N 0.03 3.53 -0.18 4.11 1.11 -1.26 -0.03 119.66 126.97 3inj s GLN 406 Ca 0.03 -0.56 -0.02 0.00 0.01 0.00 0.00 55.36 54.83 3inj s GLN 406 Cb -0.13 -3.06 -0.01 0.00 -1.01 0.00 0.00 33.01 28.81 3inj s GLN 406 CO 0.02 -0.06 -0.10 0.42 0.01 0.00 0.00 175.29 175.58 3inj s ILE 407 N 1.18 3.04 -0.00 1.08 1.01 -0.05 0.36 121.20 127.81 3inj s ILE 407 Ca 0.03 -0.63 0.08 0.00 0.00 0.00 0.00 60.65 60.13 3inj s ILE 407 Cb -0.14 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 3inj s ILE 407 CO 0.01 0.48 -0.25 -0.76 0.00 0.00 0.00 174.94 174.41 3inj s LEU 408 N 1.09 2.16 -0.01 2.97 1.02 0.20 -1.44 118.68 124.67 3inj s LEU 408 Ca 0.00 -0.48 -0.12 0.00 0.02 0.00 0.00 54.13 53.55 3inj s LEU 408 Cb -0.15 -1.35 -0.05 0.00 0.02 0.00 0.00 46.19 44.66 3inj s LEU 408 CO -0.02 0.30 0.35 -0.75 0.02 0.00 0.00 176.35 176.25 3inj s LYS 409 N -0.82 3.80 0.16 1.70 2.20 -1.26 -0.43 119.74 125.08 3inj s LYS 409 Ca 0.11 0.26 -0.01 0.00 -0.36 0.00 0.00 55.97 55.97 3inj s LYS 409 Cb -0.10 -3.18 -0.04 0.00 -1.51 0.00 0.00 37.83 33.00 3inj s LYS 409 CO 0.00 0.69 0.09 -0.59 -0.36 0.00 0.00 175.35 175.19 3inj s PHE 410 N -1.12 0.95 -0.07 4.03 -0.12 -1.05 -4.89 117.98 115.71 3inj s PHE 410 Ca 0.23 -1.27 -0.10 0.00 -0.05 0.00 0.00 56.93 55.75 3inj s PHE 410 Cb -0.15 -0.49 -0.03 0.00 -0.63 0.00 0.00 43.02 41.72 3inj s PHE 410 CO 0.12 -0.57 -0.19 1.17 -0.05 0.00 0.00 175.22 175.70 3inj n LYS 411 N -0.16 0.28 -3.84 1.99 4.81 -1.26 -0.71 118.16 119.28 3inj n LYS 411 Ca -0.03 0.11 -0.21 0.00 -0.87 0.00 0.00 58.31 57.31 3inj n LYS 411 Cb 0.64 -0.97 -0.04 0.00 0.02 0.00 0.00 35.03 34.69 3inj n LYS 411 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3inj s THR 412 N -2.31 3.45 0.20 3.15 -4.23 -1.26 -4.76 115.64 109.88 3inj s THR 412 Ca -0.16 -1.41 -0.04 0.00 -1.18 0.00 0.00 61.69 58.91 3inj s THR 412 Cb 0.02 -3.16 -0.01 0.00 1.34 0.00 0.00 72.50 70.70 3inj s THR 412 CO 0.23 -0.17 1.57 -0.29 -0.54 0.00 0.00 174.62 175.42 3inj h ILE 413 N 1.27 1.29 -0.39 2.99 2.10 -1.99 -2.67 117.51 120.12 3inj h ILE 413 Ca -0.44 -1.56 -0.12 0.00 1.08 0.00 0.00 64.86 63.82 3inj h ILE 413 Cb 1.25 1.51 -0.01 0.00 -1.09 0.00 0.00 36.82 38.48 3inj h ILE 413 CO 0.59 0.50 -0.22 -0.33 -1.08 0.00 0.00 178.15 177.61 3inj h GLU 414 N 0.54 0.83 -0.41 2.19 3.07 -2.00 -2.31 114.58 116.49 3inj h GLU 414 Ca 0.05 -0.38 0.03 0.00 -0.50 0.00 0.00 59.36 58.56 3inj h GLU 414 Cb 0.92 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.78 3inj h GLU 414 CO 0.08 1.01 0.21 1.49 -1.40 0.00 0.00 179.01 180.40 3inj h GLU 415 N 0.63 0.41 0.00 2.33 4.81 -1.96 -2.88 114.58 117.92 3inj h GLU 415 Ca 0.08 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.20 3inj h GLU 415 Cb 0.78 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 3inj h GLU 415 CO 0.06 0.27 -0.43 -0.24 -0.73 0.00 0.00 179.01 177.95 3inj h VAL 416 N 0.42 1.19 0.39 0.32 3.04 -1.36 -1.02 116.25 119.24 3inj h VAL 416 Ca 0.17 -1.52 -0.02 0.00 -1.01 0.00 0.00 66.70 64.32 3inj h VAL 416 Cb 0.07 1.85 -0.00 0.00 -2.01 0.00 0.00 31.29 31.20 3inj h VAL 416 CO -0.11 0.42 -0.22 0.58 -1.01 0.00 0.00 177.57 177.22 3inj h VAL 417 N 0.00 0.53 -0.32 1.51 2.07 -1.24 0.05 116.25 118.85 3inj h VAL 417 Ca -0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 3inj h VAL 417 Cb 0.81 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 3inj h VAL 417 CO 0.06 0.00 0.04 1.23 0.02 0.00 0.00 177.57 178.91 3inj h GLY 418 N -0.58 0.35 1.52 2.17 0.00 -1.26 -0.74 103.07 104.52 3inj h GLY 418 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.18 3inj h GLY 418 CO 0.06 -0.04 -0.27 3.21 0.00 0.00 0.00 176.54 179.50 3inj h ARG 419 N 0.14 0.55 -0.29 4.80 3.08 -1.13 -0.37 114.38 121.17 3inj h ARG 419 Ca 0.15 -0.22 -0.18 0.00 0.07 0.00 0.00 59.98 59.81 3inj h ARG 419 Cb 0.19 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 3inj h ARG 419 CO -0.23 0.77 -0.51 0.00 -1.07 0.00 0.00 179.97 178.93 3inj h ALA 420 N 1.23 0.54 0.00 0.04 0.00 -0.78 -3.19 119.26 117.10 3inj h ALA 420 Ca 0.07 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3inj h ALA 420 Cb 0.71 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3inj h ALA 420 CO 0.05 0.68 -0.08 0.09 0.00 0.00 0.00 179.25 180.00 3inj n ASN 421 N -4.01 0.68 -3.76 0.00 3.02 -0.30 -4.46 115.26 106.42 3inj n ASN 421 Ca -0.04 0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 54.59 3inj n ASN 421 Cb 0.60 -0.63 -0.02 0.00 -0.61 0.00 0.00 39.78 39.12 3inj n ASN 421 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3inj n ASN 422 N -2.12 3.49 -3.59 6.41 5.15 -0.17 -4.80 115.26 119.63 3inj n ASN 422 Ca 0.06 -2.79 -0.15 0.00 -0.60 0.00 0.00 54.58 51.09 3inj n ASN 422 Cb 0.42 -1.50 -0.07 0.00 -0.53 0.00 0.00 39.78 38.10 3inj n ASN 422 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3inj s SER 423 N 3.90 -0.71 0.12 1.20 0.15 -1.26 -5.01 113.70 112.08 3inj s SER 423 Ca 0.51 1.17 0.26 0.00 0.70 0.00 0.00 55.95 58.60 3inj s SER 423 Cb 0.13 1.12 0.97 0.00 -1.71 0.00 0.00 66.02 66.53 3inj s SER 423 CO -0.01 -0.38 1.80 0.35 1.20 0.00 0.00 173.24 176.20 3inj n THR 424 N 2.02 0.44 -2.65 6.45 -2.24 -1.26 -4.80 114.28 112.23 3inj n THR 424 Ca -0.16 -0.08 -0.26 0.00 -2.27 0.00 0.00 64.05 61.28 3inj n THR 424 Cb 0.56 -0.65 0.02 0.00 -2.10 0.00 0.00 70.33 68.16 3inj n THR 424 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3inj s TYR 425 N -3.08 3.33 -0.24 4.78 1.51 -1.26 -0.84 117.35 121.54 3inj s TYR 425 Ca 0.11 0.56 0.05 0.00 -1.01 0.00 0.00 57.07 56.78 3inj s TYR 425 Cb 0.14 -2.48 0.17 0.00 -0.11 0.00 0.00 41.96 39.68 3inj s TYR 425 CO 0.52 -0.53 1.04 0.41 -1.11 0.00 0.00 175.55 175.89 3inj n GLY 426 N -2.34 0.08 0.10 0.71 0.00 -1.23 -4.81 105.19 97.72 3inj n GLY 426 Ca 0.02 -0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 3inj n GLY 426 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3inj h LEU 427 N 0.92 0.26 -8.10 0.99 5.85 -1.82 0.14 115.31 113.56 3inj h LEU 427 Ca -0.34 -0.70 -0.04 0.00 0.84 0.00 0.00 57.88 57.63 3inj h LEU 427 Cb 1.19 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 3inj h LEU 427 CO -0.13 0.93 0.16 0.00 -0.34 0.00 0.00 178.44 179.06 3inj s ALA 428 N -3.42 -0.58 0.24 1.25 0.00 -1.26 -2.82 121.76 115.18 3inj s ALA 428 Ca -0.15 -0.78 -0.22 0.00 0.00 0.00 0.00 51.96 50.81 3inj s ALA 428 Cb 0.02 0.82 0.04 0.00 0.00 0.00 0.00 23.12 23.99 3inj s ALA 428 CO 0.75 -0.96 0.72 0.00 0.00 0.00 0.00 175.76 176.27 3inj s ALA 429 N -2.92 -1.35 0.01 0.00 0.00 0.00 -3.97 121.76 113.53 3inj s ALA 429 Ca 0.17 -0.08 -0.07 0.00 0.00 0.00 0.00 51.96 51.98 3inj s ALA 429 Cb -0.04 0.83 -0.00 0.00 0.00 0.00 0.00 23.12 23.90 3inj s ALA 429 CO 0.12 -0.98 0.13 0.00 0.00 0.00 0.00 175.76 175.03 3inj s ALA 430 N -3.81 -0.27 -0.09 0.00 0.00 -0.07 -1.13 121.76 116.40 3inj s ALA 430 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.80 3inj s ALA 430 Cb -0.04 0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.26 3inj s ALA 430 CO 0.02 -0.24 -0.05 0.08 0.00 0.00 0.00 175.76 175.57 3inj s VAL 431 N -1.75 0.76 -0.31 0.00 1.01 0.60 -0.44 120.40 120.26 3inj s VAL 431 Ca -0.12 -0.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.68 3inj s VAL 431 Cb -0.06 -0.82 0.03 0.00 0.00 0.00 0.00 36.38 35.53 3inj s VAL 431 CO -0.00 0.32 0.06 -0.36 0.00 0.00 0.00 175.10 175.12 3inj s PHE 432 N 1.74 3.21 0.09 5.22 0.40 0.30 0.64 117.98 129.58 3inj s PHE 432 Ca 0.04 -1.41 -0.25 0.00 -0.60 0.00 0.00 56.93 54.70 3inj s PHE 432 Cb -0.13 -2.21 0.08 0.00 0.51 0.00 0.00 43.02 41.27 3inj s PHE 432 CO -0.06 -0.71 0.68 -0.08 0.70 0.00 0.00 175.22 175.75 3inj s THR 433 N 1.39 0.00 -0.60 0.64 -1.32 -1.26 -2.07 115.64 112.42 3inj s THR 433 Ca -0.01 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.69 3inj s THR 433 Cb -0.19 -1.00 -0.20 0.00 -1.51 0.00 0.00 72.50 69.61 3inj s THR 433 CO 0.01 0.00 0.87 0.29 -2.21 0.00 0.00 174.62 173.58 3inj n LYS 434 N -0.14 0.28 -2.94 7.08 5.02 -1.21 -4.85 118.16 121.41 3inj n LYS 434 Ca -0.16 -0.05 -0.41 0.00 -2.02 0.00 0.00 58.31 55.68 3inj n LYS 434 Cb 0.63 -1.55 -0.04 0.00 -0.02 0.00 0.00 35.03 34.05 3inj n LYS 434 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3inj s ASP 435 N -3.77 7.05 0.09 4.39 -1.08 -1.26 -4.99 116.67 117.10 3inj s ASP 435 Ca 0.02 1.27 -0.27 0.00 -0.52 0.00 0.00 52.55 53.05 3inj s ASP 435 Cb 0.15 -2.45 -0.13 0.00 -1.46 0.00 0.00 42.92 39.02 3inj s ASP 435 CO 0.84 -0.23 1.67 0.25 0.52 0.00 0.00 175.17 178.23 3inj h LEU 436 N 7.24 -0.49 -0.84 -1.34 5.85 -2.00 -2.17 115.31 121.56 3inj h LEU 436 Ca -0.37 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 3inj h LEU 436 Cb 1.18 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 3inj h LEU 436 CO 0.78 -0.29 0.11 0.44 -0.34 0.00 0.00 178.44 179.14 3inj h ASP 437 N -0.43 0.93 0.08 1.25 3.45 -1.99 -1.73 116.42 117.97 3inj h ASP 437 Ca -0.01 -0.20 -0.08 0.00 0.43 0.00 0.00 57.03 57.17 3inj h ASP 437 Cb 0.39 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.90 3inj h ASP 437 CO -0.02 0.92 -0.26 0.11 -1.57 0.00 0.00 179.24 178.42 3inj h LYS 438 N 0.92 0.30 0.22 3.56 1.57 -1.97 0.08 116.57 121.24 3inj h LYS 438 Ca 0.19 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3inj h LYS 438 Cb 0.39 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3inj h LYS 438 CO 0.01 0.54 -0.10 0.00 -0.57 0.00 0.00 179.45 179.32 3inj h ALA 439 N 1.47 -0.29 -0.38 3.86 0.00 -0.94 -2.37 119.26 120.61 3inj h ALA 439 Ca 0.04 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 3inj h ALA 439 Cb 0.60 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3inj h ALA 439 CO 0.04 -0.54 -0.09 -0.91 0.00 0.00 0.00 179.25 177.76 3inj h ASN 440 N -0.55 0.63 -0.07 0.00 2.35 -1.22 -1.48 115.58 115.25 3inj h ASN 440 Ca -0.03 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 3inj h ASN 440 Cb 0.41 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.60 3inj h ASN 440 CO 0.05 0.76 0.04 0.22 -1.65 0.00 0.00 177.43 176.85 3inj h TYR 441 N 0.60 0.08 0.04 1.19 3.20 -1.01 -2.99 116.97 118.08 3inj h TYR 441 Ca 0.11 0.00 -0.24 0.00 3.14 0.00 0.00 58.73 61.74 3inj h TYR 441 Cb 0.51 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.75 3inj h TYR 441 CO 0.02 0.06 -1.03 -0.07 -1.64 0.00 0.00 178.16 175.50 3inj h LEU 442 N 0.09 0.52 -1.08 2.82 3.38 -1.20 -2.23 115.31 117.59 3inj h LEU 442 Ca 0.02 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 3inj h LEU 442 Cb -0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3inj h LEU 442 CO -0.01 1.27 -0.29 0.77 0.09 0.00 0.00 178.44 180.27 3inj h SER 443 N 0.19 0.29 -0.27 -0.43 4.64 -1.35 -0.38 113.55 116.23 3inj h SER 443 Ca -0.10 -0.10 -0.18 0.00 -0.47 0.00 0.00 61.79 60.95 3inj h SER 443 Cb 1.69 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.70 3inj h SER 443 CO 0.18 0.58 -0.52 -0.61 -0.87 0.00 0.00 176.83 175.58 3inj h GLN 444 N 0.25 0.86 0.00 4.77 4.15 -1.52 -3.34 115.11 120.28 3inj h GLN 444 Ca 0.04 -0.53 -0.15 0.00 0.77 0.00 0.00 58.65 58.78 3inj h GLN 444 Cb 0.65 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.37 3inj h GLN 444 CO 0.05 1.17 -0.90 0.00 -1.93 0.00 0.00 178.83 177.22 3inj h ALA 445 N 0.73 0.63 -2.57 3.38 0.00 -1.04 -3.46 119.26 116.93 3inj h ALA 445 Ca 0.02 -0.67 -0.53 0.00 0.00 0.00 0.00 54.91 53.73 3inj h ALA 445 Cb 1.12 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.98 3inj h ALA 445 CO 0.12 0.83 0.67 -0.51 0.00 0.00 0.00 179.25 180.36 3inj s LEU 446 N -6.26 4.38 -1.15 0.00 1.43 -0.18 -4.94 118.68 111.96 3inj s LEU 446 Ca 0.01 2.27 -0.07 0.00 -1.03 0.00 0.00 54.13 55.31 3inj s LEU 446 Cb 0.08 -3.59 0.26 0.00 0.03 0.00 0.00 46.19 42.97 3inj s LEU 446 CO 0.78 -0.57 1.52 0.00 0.23 0.00 0.00 176.35 178.30 3inj n GLN 447 N 3.59 4.03 -3.89 1.70 6.02 -1.26 -4.94 117.38 122.63 3inj n GLN 447 Ca 0.09 -4.23 -0.09 0.00 -0.01 0.00 0.00 57.00 52.76 3inj n GLN 447 Cb 0.43 -2.66 -0.08 0.00 1.02 0.00 0.00 30.24 28.96 3inj n GLN 447 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3inj s ALA 448 N -1.42 -0.12 0.09 -1.58 0.00 -1.26 -4.59 121.76 112.87 3inj s ALA 448 Ca 0.34 -0.68 -0.15 0.00 0.00 0.00 0.00 51.96 51.47 3inj s ALA 448 Cb 0.03 0.43 -0.13 0.00 0.00 0.00 0.00 23.12 23.45 3inj s ALA 448 CO 0.04 -0.47 1.33 0.78 0.00 0.00 0.00 175.76 177.44 3inj h GLY 449 N 2.88 0.77 -5.29 0.00 0.00 -1.25 -3.43 103.07 96.76 3inj h GLY 449 Ca -0.34 -0.96 -0.65 0.00 0.00 0.00 0.00 47.33 45.38 3inj h GLY 449 CO 0.57 0.86 -0.87 -1.59 0.00 0.00 0.00 176.54 175.52 3inj s THR 450 N -3.97 1.86 -0.23 4.70 2.01 -1.16 -4.83 115.64 114.02 3inj s THR 450 Ca -0.12 -0.92 -0.01 0.00 0.31 0.00 0.00 61.69 60.95 3inj s THR 450 Cb 0.08 -1.60 0.03 0.00 0.01 0.00 0.00 72.50 71.01 3inj s THR 450 CO 0.86 0.52 -0.10 -0.69 -0.69 0.00 0.00 174.62 174.51 3inj s VAL 451 N 0.21 2.62 0.00 3.82 1.01 -1.26 -0.82 120.40 125.97 3inj s VAL 451 Ca -0.12 -1.03 -0.17 0.00 0.00 0.00 0.00 61.98 60.65 3inj s VAL 451 Cb -0.16 -2.29 -0.06 0.00 0.00 0.00 0.00 36.38 33.88 3inj s VAL 451 CO 0.06 0.28 0.49 0.26 0.00 0.00 0.00 175.10 176.19 3inj s TRP 452 N 1.30 3.71 -0.25 5.22 0.51 -0.28 -4.98 118.94 124.17 3inj s TRP 452 Ca 0.01 1.08 -0.01 0.00 -2.12 0.00 0.00 56.10 55.06 3inj s TRP 452 Cb -0.16 -2.43 0.03 0.00 -0.81 0.00 0.00 33.47 30.10 3inj s TRP 452 CO -0.07 0.51 -0.08 0.08 -0.51 0.00 0.00 176.95 176.89 3inj s VAL 453 N -0.70 2.68 -1.62 4.03 1.01 -1.26 -0.29 120.40 124.25 3inj s VAL 453 Ca 0.26 -1.14 0.00 0.00 0.00 0.00 0.00 61.98 61.11 3inj s VAL 453 Cb -0.17 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.82 3inj s VAL 453 CO 0.15 0.18 0.00 0.59 0.00 0.00 0.00 175.10 176.02 3inj n ASN 454 N 4.62 -4.98 -2.78 3.32 3.02 0.21 -4.95 115.26 113.72 3inj n ASN 454 Ca -0.16 0.22 -0.08 0.00 -0.03 0.00 0.00 54.58 54.52 3inj n ASN 454 Cb 0.46 -4.01 0.03 0.00 -0.61 0.00 0.00 39.78 35.65 3inj n ASN 454 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3inj s TYR 456 N -2.28 -0.68 -1.52 0.00 5.04 -1.26 -4.74 117.35 111.92 3inj s TYR 456 Ca 0.16 1.33 -0.06 0.00 -2.44 0.00 0.00 57.07 56.06 3inj s TYR 456 Cb -0.05 0.37 0.01 0.00 0.35 0.00 0.00 41.96 42.65 3inj s TYR 456 CO 0.11 -0.53 0.64 -0.25 -1.34 0.00 0.00 175.55 174.18 3inj n ASP 457 N 1.42 -5.87 -4.50 4.32 8.00 -1.26 -4.92 116.55 113.74 3inj n ASP 457 Ca -0.17 -0.32 -0.43 0.00 0.71 0.00 0.00 54.79 54.58 3inj n ASP 457 Cb 0.56 -4.74 -0.04 0.00 -0.02 0.00 0.00 41.12 36.88 3inj n ASP 457 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3inj s VAL 458 N -3.16 4.47 -0.08 2.53 1.01 -1.26 -5.02 120.40 118.88 3inj s VAL 458 Ca 0.34 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.37 3inj s VAL 458 Cb -0.15 -4.52 -0.03 0.00 0.00 0.00 0.00 36.38 31.68 3inj s VAL 458 CO 0.42 -1.11 -0.08 -0.36 0.00 0.00 0.00 175.10 173.98 3inj s PHE 459 N 3.72 2.91 -0.01 5.22 0.40 -1.26 -5.11 117.98 123.85 3inj s PHE 459 Ca 0.26 -0.09 0.02 0.00 -0.60 0.00 0.00 56.93 56.52 3inj s PHE 459 Cb -0.14 -1.75 0.00 0.00 0.51 0.00 0.00 43.02 41.64 3inj s PHE 459 CO 0.17 0.22 -0.06 0.20 0.70 0.00 0.00 175.22 176.44 3inj s GLY 460 N -0.55 0.37 0.67 4.36 0.00 -1.26 -5.00 107.32 105.90 3inj s GLY 460 Ca 0.08 -0.24 0.34 0.00 0.00 0.00 0.00 44.72 44.90 3inj s GLY 460 CO 0.02 -0.09 2.05 0.00 0.00 0.00 0.00 173.10 175.08 3inj h ALA 461 N 6.25 1.25 0.00 3.20 0.00 -1.95 -0.97 119.26 127.03 3inj h ALA 461 Ca -0.31 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 3inj h ALA 461 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3inj h ALA 461 CO 0.49 -0.24 -0.42 1.96 0.00 0.00 0.00 179.25 181.04 3inj h GLN 462 N 0.00 0.00 -5.29 0.00 7.50 -1.94 0.14 115.11 115.51 3inj h GLN 462 Ca 0.00 0.00 -0.65 0.00 0.50 0.00 0.00 58.65 58.50 3inj h GLN 462 Cb 0.48 0.00 -0.25 0.00 0.05 0.00 0.00 27.48 27.76 3inj h GLN 462 CO -0.00 0.21 -0.73 -1.12 -1.50 0.00 0.00 178.83 175.69 3inj s SER 463 N -6.17 4.28 0.62 1.46 0.01 -0.37 -4.03 113.70 109.50 3inj s SER 463 Ca 0.04 -0.27 -0.18 0.00 1.31 0.00 0.00 55.95 56.86 3inj s SER 463 Cb 0.07 -1.67 -0.02 0.00 0.21 0.00 0.00 66.02 64.60 3inj s SER 463 CO 0.72 0.16 1.19 -2.16 0.41 0.00 0.00 173.24 173.56 3inj s PRO 464 N 0.42 2.85 -0.01 12.44 0.04 -1.26 -4.30 135.00 145.18 3inj s PRO 464 Ca -0.08 1.73 0.01 0.00 0.04 0.00 0.00 61.00 62.70 3inj s PRO 464 Cb -0.15 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3inj s PRO 464 CO 0.04 -1.28 -0.03 0.12 0.04 0.00 0.00 177.00 175.90 3inj s PHE 465 N -1.78 0.32 0.00 0.56 5.36 0.81 -4.90 117.98 118.35 3inj s PHE 465 Ca 0.75 -0.05 0.00 0.00 -0.96 0.00 0.00 56.93 56.67 3inj s PHE 465 Cb -0.28 -0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.16 3inj s PHE 465 CO 0.35 -0.03 0.00 0.41 -1.46 0.00 0.00 175.22 174.50 3inj n GLY 466 N 3.19 1.51 3.92 13.12 0.00 -1.26 -0.18 105.19 125.49 3inj n GLY 466 Ca -0.15 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 3inj n GLY 466 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3inj s GLY 467 N 0.00 1.89 0.51 -0.02 0.00 -1.26 -3.81 107.32 104.64 3inj s GLY 467 Ca 0.00 -0.78 -0.01 0.00 0.00 0.00 0.00 44.72 43.93 3inj s GLY 467 CO 0.00 -0.73 0.75 -0.19 0.00 0.00 0.00 173.10 172.93 3inj s TYR 468 N -1.81 3.11 0.00 1.90 1.51 -0.01 -4.38 117.35 117.67 3inj s TYR 468 Ca 0.39 0.24 0.00 0.00 -1.01 0.00 0.00 57.07 56.68 3inj s TYR 468 Cb -0.11 -2.54 0.00 0.00 -0.11 0.00 0.00 41.96 39.20 3inj s TYR 468 CO 0.28 -0.62 0.00 1.63 -1.11 0.00 0.00 175.55 175.73 3inj n LYS 469 N -2.27 0.00 -0.51 -0.62 5.02 -1.26 -1.58 118.16 116.95 3inj n LYS 469 Ca 0.04 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.39 3inj n LYS 469 Cb 0.58 0.00 0.26 0.00 -0.02 0.00 0.00 35.03 35.86 3inj n LYS 469 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3inj n MET 470 N 14.00 3.22 0.00 1.97 2.81 -0.02 -3.57 117.12 135.52 3inj n MET 470 Ca 0.00 -2.07 0.15 0.00 -1.81 0.00 0.00 57.70 53.97 3inj n MET 470 Cb 0.00 -1.83 0.81 0.00 -0.71 0.00 0.00 33.22 31.49 3inj n MET 470 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3inj n SER 471 N 0.61 0.14 0.00 7.83 7.64 -0.61 -4.50 113.62 124.74 3inj n SER 471 Ca 0.19 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.41 3inj n SER 471 Cb 0.76 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 3inj n SER 471 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3inj n GLY 472 N 1.15 0.27 3.21 0.23 0.00 -1.23 -0.17 105.19 108.65 3inj n GLY 472 Ca 0.19 -2.28 -0.10 0.00 0.00 0.00 0.00 46.02 43.83 3inj n GLY 472 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3inj s SER 473 N -3.97 0.03 0.10 1.61 1.04 -0.27 -4.38 113.70 107.85 3inj s SER 473 Ca 0.00 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 55.96 3inj s SER 473 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 3inj s SER 473 CO 0.00 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.16 3inj n GLY 474 N 0.24 -2.52 3.36 7.32 0.00 -1.26 -2.17 105.19 110.17 3inj n GLY 474 Ca -0.17 -1.40 -0.26 0.00 0.00 0.00 0.00 46.02 44.20 3inj n GLY 474 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3inj s ARG 475 N -2.88 1.33 0.33 1.61 1.81 -1.26 -4.32 118.95 115.57 3inj s ARG 475 Ca 0.00 -1.36 0.10 0.00 -1.72 0.00 0.00 55.73 52.75 3inj s ARG 475 Cb 0.00 -1.64 -0.06 0.00 -0.45 0.00 0.00 34.95 32.81 3inj s ARG 475 CO 0.00 0.37 -0.05 -1.21 -0.68 0.00 0.00 175.30 173.73 3inj s GLU 476 N -2.32 1.96 0.37 3.54 2.02 0.74 -4.12 118.70 120.89 3inj s GLU 476 Ca 0.14 -1.79 0.00 0.00 0.02 0.00 0.00 54.97 53.34 3inj s GLU 476 Cb -0.09 -1.86 0.00 0.00 0.10 0.00 0.00 34.13 32.29 3inj s GLU 476 CO 0.07 0.18 0.00 1.28 0.02 0.00 0.00 175.26 176.80 3inj n LEU 477 N -0.86 -0.63 0.00 1.80 4.77 -1.26 -0.13 117.00 120.68 3inj n LEU 477 Ca -0.05 1.47 0.09 0.00 -0.03 0.00 0.00 56.01 57.50 3inj n LEU 477 Cb 0.62 -2.26 -0.02 0.00 -2.33 0.00 0.00 43.42 39.43 3inj n LEU 477 CO 0.42 -1.53 -0.13 0.61 -1.33 0.00 0.00 177.39 175.43 3inj n GLY 478 N -3.55 -1.72 0.26 -0.72 0.00 0.48 -1.85 105.19 98.10 3inj n GLY 478 Ca -0.05 -1.20 0.09 0.00 0.00 0.00 0.00 46.02 44.86 3inj n GLY 478 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3inj h GLU 479 N 0.00 0.00 -0.15 1.61 4.81 -1.87 -2.26 114.58 116.72 3inj h GLU 479 Ca 0.01 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 3inj h GLU 479 Cb 0.63 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 3inj h GLU 479 CO 0.00 0.07 -0.15 1.88 -0.73 0.00 0.00 179.01 180.08 3inj h TYR 480 N 0.00 0.26 0.00 0.92 -1.99 -1.93 -2.64 116.97 111.59 3inj h TYR 480 Ca -0.00 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.70 3inj h TYR 480 Cb 0.13 -0.07 0.00 0.00 2.00 0.00 0.00 36.73 38.79 3inj h TYR 480 CO 0.00 0.40 0.00 0.41 -0.00 0.00 0.00 178.16 178.97 3inj n GLY 481 N -0.81 -0.88 0.14 3.88 0.00 -0.77 -1.84 105.19 104.91 3inj n GLY 481 Ca -0.01 0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.26 3inj n GLY 481 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3inj h LEU 482 N 0.00 0.00 -0.64 0.99 3.38 -1.63 -3.39 115.31 114.01 3inj h LEU 482 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3inj h LEU 482 Cb 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3inj h LEU 482 CO 0.00 0.19 0.19 1.56 0.09 0.00 0.00 178.44 180.48 3inj h GLN 483 N 0.00 1.00 0.00 1.13 4.20 -1.53 -1.94 115.11 117.98 3inj h GLN 483 Ca -0.03 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.46 3inj h GLN 483 Cb 1.18 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.81 3inj h GLN 483 CO 0.02 0.89 0.00 0.00 -0.67 0.00 0.00 178.83 179.06 3inj n ALA 484 N -2.41 1.68 -0.73 3.87 0.00 -1.26 -2.35 120.51 119.30 3inj n ALA 484 Ca 0.04 -0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.54 3inj n ALA 484 Cb 0.22 -1.28 0.20 0.00 0.00 0.00 0.00 19.45 18.59 3inj n ALA 484 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3inj n TYR 485 N -1.71 0.64 -5.21 0.00 4.02 -0.75 -4.91 117.16 109.24 3inj n TYR 485 Ca 0.03 -0.77 -0.30 0.00 -0.01 0.00 0.00 57.90 56.85 3inj n TYR 485 Cb 0.19 -0.20 -0.16 0.00 -0.02 0.00 0.00 39.34 39.15 3inj n TYR 485 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3inj s THR 486 N -2.24 1.95 -0.18 -0.72 2.01 -0.99 -3.03 115.64 112.44 3inj s THR 486 Ca 0.33 -1.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.28 3inj s THR 486 Cb 0.25 -1.64 -0.01 0.00 0.01 0.00 0.00 72.50 71.12 3inj s THR 486 CO 0.09 0.55 -0.08 -0.70 -0.69 0.00 0.00 174.62 173.79 3inj s GLU 487 N -0.32 3.37 -0.15 4.92 2.56 0.21 -4.72 118.70 124.58 3inj s GLU 487 Ca 0.02 -0.65 -0.19 0.00 0.00 0.00 0.00 54.97 54.15 3inj s GLU 487 Cb -0.12 -2.84 -0.04 0.00 2.00 0.00 0.00 34.13 33.13 3inj s GLU 487 CO 0.02 -0.03 0.52 0.08 -0.56 0.00 0.00 175.26 175.29 3inj s VAL 488 N 1.01 5.13 -0.13 3.70 1.01 -1.26 -0.88 120.40 128.98 3inj s VAL 488 Ca -0.00 1.01 0.03 0.00 0.00 0.00 0.00 61.98 63.01 3inj s VAL 488 Cb -0.15 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.38 3inj s VAL 488 CO -0.01 0.24 -0.22 -0.75 0.00 0.00 0.00 175.10 174.37 3inj s LYS 489 N 1.15 3.06 -0.06 2.72 2.20 -0.64 -4.98 119.74 123.19 3inj s LYS 489 Ca 0.26 -0.85 -0.16 0.00 -0.36 0.00 0.00 55.97 54.86 3inj s LYS 489 Cb -0.15 -2.42 -0.05 0.00 -1.51 0.00 0.00 37.83 33.70 3inj s LYS 489 CO 0.11 0.06 0.44 0.99 -0.36 0.00 0.00 175.35 176.58 3inj s THR 490 N 0.64 5.09 -0.16 3.43 2.01 -1.26 -0.34 115.64 125.05 3inj s THR 490 Ca -0.11 0.89 0.01 0.00 0.31 0.00 0.00 61.69 62.79 3inj s THR 490 Cb -0.16 -3.76 0.01 0.00 0.01 0.00 0.00 72.50 68.59 3inj s THR 490 CO 0.02 0.46 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.54 3inj s VAL 491 N -0.27 2.32 -0.18 3.82 1.01 0.78 -4.98 120.40 122.90 3inj s VAL 491 Ca 0.24 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.35 3inj s VAL 491 Cb -0.16 -1.96 0.03 0.00 0.00 0.00 0.00 36.38 34.29 3inj s VAL 491 CO 0.12 0.53 -0.12 -0.89 0.00 0.00 0.00 175.10 174.73 3inj s THR 492 N 0.94 1.65 -0.14 3.92 2.01 -1.26 -0.96 115.64 121.79 3inj s THR 492 Ca -0.04 -0.87 0.01 0.00 0.31 0.00 0.00 61.69 61.11 3inj s THR 492 Cb -0.15 -1.64 0.00 0.00 0.01 0.00 0.00 72.50 70.72 3inj s THR 492 CO -0.03 0.30 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.32 3inj s VAL 493 N 1.42 2.42 0.13 3.82 1.01 0.12 -4.94 120.40 124.38 3inj s VAL 493 Ca 0.01 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.82 3inj s VAL 493 Cb -0.15 -2.00 -0.09 0.00 0.00 0.00 0.00 36.38 34.14 3inj s VAL 493 CO -0.09 0.53 1.56 -0.75 0.00 0.00 0.00 175.10 176.35 3inj s LYS 494 N 0.74 4.23 0.21 2.72 2.20 -1.26 -0.26 119.74 128.32 3inj s LYS 494 Ca -0.08 2.30 0.11 0.00 -0.36 0.00 0.00 55.97 57.94 3inj s LYS 494 Cb -0.16 -3.29 -0.05 0.00 -1.51 0.00 0.00 37.83 32.82 3inj s LYS 494 CO 0.01 -0.61 -0.21 0.14 -0.36 0.00 0.00 175.35 174.31 3inj s VAL 495 N 1.56 2.21 0.19 4.02 -7.23 -0.69 -4.87 120.40 115.58 3inj s VAL 495 Ca 0.70 -2.11 -0.12 0.00 -1.81 0.00 0.00 61.98 58.65 3inj s VAL 495 Cb -0.41 -2.09 0.10 0.00 0.56 0.00 0.00 36.38 34.54 3inj s VAL 495 CO 0.31 -0.26 1.77 -0.65 -0.31 0.00 0.00 175.10 175.96 3inj h PRO 496 N 2.95 0.46 -1.06 4.82 0.11 -1.95 -3.43 132.00 133.89 3inj h PRO 496 Ca -0.43 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.74 3inj h PRO 496 Cb 1.22 -0.10 -0.21 0.00 0.11 0.00 0.00 31.00 32.02 3inj h PRO 496 CO 0.52 0.30 -0.26 -1.14 -0.21 0.00 0.00 178.00 177.21 3inj s GLN 497 N -6.12 0.57 0.09 1.05 0.74 -1.26 -5.05 119.66 109.68 3inj s GLN 497 Ca -0.13 1.03 -0.31 0.00 0.05 0.00 0.00 55.36 56.01 3inj s GLN 497 Cb 0.15 0.57 -0.07 0.00 1.10 0.00 0.00 33.01 34.76 3inj s GLN 497 CO 0.74 -0.60 1.29 0.21 -0.55 0.00 0.00 175.29 176.38 3inj s LYS 498 N 2.86 4.38 0.18 1.67 2.36 -1.26 -5.05 119.74 124.88 3inj s LYS 498 Ca 0.19 1.91 0.09 0.00 -2.55 0.00 0.00 55.97 55.61 3inj s LYS 498 Cb -0.15 -3.30 -0.04 0.00 -1.05 0.00 0.00 37.83 33.29 3inj s LYS 498 CO -0.21 -0.34 -0.17 -0.80 1.55 0.00 0.00 175.35 175.38 3inj s ASN 499 N 1.08 2.71 0.00 1.43 0.01 -1.26 -4.99 114.94 113.91 3inj s ASN 499 Ca 0.61 -0.90 0.01 0.00 -0.71 0.00 0.00 52.86 51.87 3inj s ASN 499 Cb -0.33 -0.16 0.05 0.00 0.41 0.00 0.00 41.25 41.22 3inj s ASN 499 CO 0.30 -0.06 0.55 -1.54 -1.51 0.00 0.00 177.10 174.84